Sunday, February 26, 2012

http://ChemLookup.com Compounds




CAS RN: 66277-10-9
CAS Name: 2-[4,6-diamino-3-[[3-amino-6-(1-aminoethyl)-2-oxanyl]oxy]-2-hydroxycyclohexyl]oxy-4-(methylamino)oxane-3,5-diol
OPENEYE Name: 2-[4,6-diamino-3-[3-amino-6-(1-aminoethyl)tetrahydropyran-2-yl]oxy-2-hydroxy-cyclohexoxy]-4-(methylamino)tetrahydropyran-3,5-diol
IUPAC Name: 2-[4,6-diamino-3-[3-amino-6-(1-aminoethyl)oxan-2-yl]oxy-2-hydroxycyclohexyl]oxy-4-(methylamino)oxane-3,5-diol
SYSTEMATIC NAME: 2-[4,6-bis(azanyl)-3-[3-azanyl-6-(1-azanylethyl)oxan-2-yl]oxy-2-oxidanyl-cyclohexyl]oxy-4-(methylamino)oxane-3,5-diol
MOLECULAR FORMULA: C19H39N5O7
MOLECULAR WEIGHT: 449.54226
SMILES: CC(C1CCC(C(O1)OC2C(CC(C(C2O)OC3C(C(C(CO3)O)NC)O)N)N)N)N
Structure:

CAS RN: 66276-09-3
CAS Name: N-methyl-3-oxo-4,5-dihydro-1H-2-benzazepine-2-carboxamide
OPENEYE Name: N-methyl-3-oxo-4,5-dihydro-1H-2-benzazepine-2-carboxamide
IUPAC Name: N-methyl-3-oxo-4,5-dihydro-1H-2-benzazepine-2-carboxamide
SYSTEMATIC NAME: N-methyl-3-oxidanylidene-4,5-dihydro-1H-2-benzazepine-2-carboxamide
MOLECULAR FORMULA: C12H14N2O2
MOLECULAR WEIGHT: 218.25176
SMILES: CNC(=O)N1CC2=CC=CC=C2CCC1=O
Structure:

CAS RN: 66267-67-2
CAS Name: 2-hydroxy-2-phenylacetic acid 2-(2-ethoxyethoxy)ethyl ester
OPENEYE Name: 2-(2-ethoxyethoxy)ethyl 2-hydroxy-2-phenyl-acetate
IUPAC Name: 2-(2-ethoxyethoxy)ethyl 2-hydroxy-2-phenylacetate
SYSTEMATIC NAME: 2-(2-ethoxyethoxy)ethyl 2-oxidanyl-2-phenyl-ethanoate
MOLECULAR FORMULA: C14H20O5
MOLECULAR WEIGHT: 268.3056
SMILES: CCOCCOCCOC(=O)C(C1=CC=CC=C1)O
Structure:

CAS RN: 68894-13-3
CAS Name: 2-hydroxy-2-phenylacetic acid 2-(2-ethoxyethoxy)ethyl ester
OPENEYE Name: 2-(2-ethoxyethoxy)ethyl 2-hydroxy-2-phenyl-acetate
IUPAC Name: 2-(2-ethoxyethoxy)ethyl 2-hydroxy-2-phenylacetate
SYSTEMATIC NAME: 2-(2-ethoxyethoxy)ethyl 2-oxidanyl-2-phenyl-ethanoate
MOLECULAR FORMULA: C14H20O5
MOLECULAR WEIGHT: 268.3056
SMILES: CCOCCOCCOC(=O)C(C1=CC=CC=C1)O
Structure:

CAS RN: 66223-20-9
CAS Name: 2-methyl-7-(1-pyridin-1-iumylmethyl)-3,8-dioxaspiro[4.4]nonane-4,9-dione bromide
OPENEYE Name: 2-methyl-7-(pyridin-1-ium-1-ylmethyl)-3,8-dioxaspiro[4.4]nonane-4,9-dione bromide
IUPAC Name: 2-methyl-7-(pyridin-1-ium-1-ylmethyl)-3,8-dioxaspiro[4.4]nonane-4,9-dione bromide
SYSTEMATIC NAME: 2-methyl-7-(pyridin-1-ium-1-ylmethyl)-3,8-dioxaspiro[4.4]nonane-4,9-dione bromide
MOLECULAR FORMULA: C14H16BrNO4
MOLECULAR WEIGHT: 342.18514
SMILES: CC1CC2(CC(OC2=O)C[N+]3=CC=CC=C3)C(=O)O1.[Br-]
Structure:

CAS RN: 73260-19-2
CAS Name: 5-[3-(4-chloro-2-cyclohexylphenoxy)propoxy]-6-methylpyrimidine-2,4-diamine
OPENEYE Name: 5-[3-(4-chloro-2-cyclohexyl-phenoxy)propoxy]-6-methyl-pyrimidine-2,4-diamine
IUPAC Name: 5-[3-(4-chloro-2-cyclohexylphenoxy)propoxy]-6-methylpyrimidine-2,4-diamine
SYSTEMATIC NAME: 5-[3-(4-chloranyl-2-cyclohexyl-phenoxy)propoxy]-6-methyl-pyrimidine-2,4-diamine
MOLECULAR FORMULA: C20H27ClN4O2
MOLECULAR WEIGHT: 390.90698
SMILES: CC1=C(C(=NC(=N1)N)N)OCCCOC2=C(C=C(C=C2)Cl)C3CCCCC3
Structure:

CAS RN: 66204-49-7
CAS Name: 5-[3-(4-chloro-2-cyclohexylphenoxy)propoxy]-6-methylpyrimidine-2,4-diamine hydrochloride
OPENEYE Name: 5-[3-(4-chloro-2-cyclohexyl-phenoxy)propoxy]-6-methyl-pyrimidine-2,4-diamine hydrochloride
IUPAC Name: 5-[3-(4-chloro-2-cyclohexylphenoxy)propoxy]-6-methylpyrimidine-2,4-diamine hydrochloride
SYSTEMATIC NAME: 5-[3-(4-chloranyl-2-cyclohexyl-phenoxy)propoxy]-6-methyl-pyrimidine-2,4-diamine hydrochloride
MOLECULAR FORMULA: C20H28Cl2N4O2
MOLECULAR WEIGHT: 427.36792
SMILES: CC1=C(C(=NC(=N1)N)N)OCCCOC2=C(C=C(C=C2)Cl)C3CCCCC3.Cl
Structure:

CAS RN: 66203-98-3
CAS Name: 1-[4,7-dimethoxy-6-[1-(1-piperidinyl)propan-2-yloxy]-5-benzofuranyl]-3-methylurea
OPENEYE Name: 1-[4,7-dimethoxy-6-[1-methyl-2-(1-piperidyl)ethoxy]benzofuran-5-yl]-3-methyl-urea
IUPAC Name: 1-[4,7-dimethoxy-6-(1-piperidin-1-ylpropan-2-yloxy)-1-benzofuran-5-yl]-3-methylurea
SYSTEMATIC NAME: 1-[4,7-dimethoxy-6-(1-piperidin-1-ylpropan-2-yloxy)-1-benzofuran-5-yl]-3-methyl-urea
MOLECULAR FORMULA: C20H29N3O5
MOLECULAR WEIGHT: 391.46136
SMILES: CC(CN1CCCCC1)OC2=C(C3=C(C=CO3)C(=C2NC(=O)NC)OC)OC
Structure:

CAS RN: 66203-91-6
CAS Name: 1-[4,7-dimethoxy-6-[2-(propan-2-ylamino)ethoxy]-5-benzofuranyl]-3-methylurea
OPENEYE Name: 1-[6-[2-(isopropylamino)ethoxy]-4,7-dimethoxy-benzofuran-5-yl]-3-methyl-urea
IUPAC Name: 1-[4,7-dimethoxy-6-[2-(propan-2-ylamino)ethoxy]-1-benzofuran-5-yl]-3-methylurea
SYSTEMATIC NAME: 1-[4,7-dimethoxy-6-[2-(propan-2-ylamino)ethoxy]-1-benzofuran-5-yl]-3-methyl-urea
MOLECULAR FORMULA: C17H25N3O5
MOLECULAR WEIGHT: 351.3975
SMILES: CC(C)NCCOC1=C(C2=C(C=CO2)C(=C1NC(=O)NC)OC)OC
Structure:

CAS RN: 66203-17-6
CAS Name: N-[6-[2-(1-azocanyl)ethoxy]-4,7-dimethoxy-5-benzofuranyl]acetamide hydrochloride
OPENEYE Name: N-[6-[2-(azocan-1-yl)ethoxy]-4,7-dimethoxy-benzofuran-5-yl]acetamide hydrochloride
IUPAC Name: N-[6-[2-(azocan-1-yl)ethoxy]-4,7-dimethoxy-1-benzofuran-5-yl]acetamide hydrochloride
SYSTEMATIC NAME: N-[6-[2-(azocan-1-yl)ethoxy]-4,7-dimethoxy-1-benzofuran-5-yl]ethanamide hydrochloride
MOLECULAR FORMULA: C21H31ClN2O5
MOLECULAR WEIGHT: 426.93424
SMILES: CC(=O)NC1=C(C2=C(C(=C1OCCN3CCCCCCC3)OC)OC=C2)OC.Cl
Structure:

CAS RN: 66203-16-5
CAS Name: N-[6-[2-(1-azepanyl)ethoxy]-4,7-dimethoxy-5-benzofuranyl]acetamide hydrochloride
OPENEYE Name: N-[6-[2-(azepan-1-yl)ethoxy]-4,7-dimethoxy-benzofuran-5-yl]acetamide hydrochloride
IUPAC Name: N-[6-[2-(azepan-1-yl)ethoxy]-4,7-dimethoxy-1-benzofuran-5-yl]acetamide hydrochloride
SYSTEMATIC NAME: N-[6-[2-(azepan-1-yl)ethoxy]-4,7-dimethoxy-1-benzofuran-5-yl]ethanamide hydrochloride
MOLECULAR FORMULA: C20H29ClN2O5
MOLECULAR WEIGHT: 412.90766
SMILES: CC(=O)NC1=C(C2=C(C(=C1OCCN3CCCCCC3)OC)OC=C2)OC.Cl
Structure:

CAS RN: 66203-08-5
CAS Name: 1-[6-[2-(cyclohexylamino)ethoxy]-4,7-dimethoxy-5-benzofuranyl]-3-methylurea
OPENEYE Name: 1-[6-[2-(cyclohexylamino)ethoxy]-4,7-dimethoxy-benzofuran-5-yl]-3-methyl-urea
IUPAC Name: 1-[6-[2-(cyclohexylamino)ethoxy]-4,7-dimethoxy-1-benzofuran-5-yl]-3-methylurea
SYSTEMATIC NAME: 1-[6-[2-(cyclohexylamino)ethoxy]-4,7-dimethoxy-1-benzofuran-5-yl]-3-methyl-urea
MOLECULAR FORMULA: C20H29N3O5
MOLECULAR WEIGHT: 391.46136
SMILES: CNC(=O)NC1=C(C2=C(C(=C1OCCNC3CCCCC3)OC)OC=C2)OC
Structure:

CAS RN: 66203-07-4
CAS Name: 1-[4,7-dimethoxy-6-[2-(methylamino)ethoxy]-5-benzofuranyl]-3-methylurea
OPENEYE Name: 1-[4,7-dimethoxy-6-[2-(methylamino)ethoxy]benzofuran-5-yl]-3-methyl-urea
IUPAC Name: 1-[4,7-dimethoxy-6-[2-(methylamino)ethoxy]-1-benzofuran-5-yl]-3-methylurea
SYSTEMATIC NAME: 1-[4,7-dimethoxy-6-[2-(methylamino)ethoxy]-1-benzofuran-5-yl]-3-methyl-urea
MOLECULAR FORMULA: C15H21N3O5
MOLECULAR WEIGHT: 323.34434
SMILES: CNCCOC1=C(C2=C(C=CO2)C(=C1NC(=O)NC)OC)OC
Structure:

CAS RN: 66203-06-3
CAS Name: 3-[4,7-dimethoxy-6-[2-(1-piperidinyl)ethoxy]-5-benzofuranyl]-1,1-dimethylurea
OPENEYE Name: 3-[4,7-dimethoxy-6-[2-(1-piperidyl)ethoxy]benzofuran-5-yl]-1,1-dimethyl-urea
IUPAC Name: 3-[4,7-dimethoxy-6-(2-piperidin-1-ylethoxy)-1-benzofuran-5-yl]-1,1-dimethylurea
SYSTEMATIC NAME: 3-[4,7-dimethoxy-6-(2-piperidin-1-ylethoxy)-1-benzofuran-5-yl]-1,1-dimethyl-urea
MOLECULAR FORMULA: C20H29N3O5
MOLECULAR WEIGHT: 391.46136
SMILES: CN(C)C(=O)NC1=C(C2=C(C(=C1OCCN3CCCCC3)OC)OC=C2)OC
Structure:

CAS RN: 66203-04-1
CAS Name: 1-[4,7-dimethoxy-6-[2-(4-methyl-1-piperazinyl)ethoxy]-5-benzofuranyl]-3-methylurea
OPENEYE Name: 1-[4,7-dimethoxy-6-[2-(4-methylpiperazin-1-yl)ethoxy]benzofuran-5-yl]-3-methyl-urea
IUPAC Name: 1-[4,7-dimethoxy-6-[2-(4-methylpiperazin-1-yl)ethoxy]-1-benzofuran-5-yl]-3-methylurea
SYSTEMATIC NAME: 1-[4,7-dimethoxy-6-[2-(4-methylpiperazin-1-yl)ethoxy]-1-benzofuran-5-yl]-3-methyl-urea
MOLECULAR FORMULA: C19H28N4O5
MOLECULAR WEIGHT: 392.44942
SMILES: CNC(=O)NC1=C(C2=C(C(=C1OCCN3CCN(CC3)C)OC)OC=C2)OC
Structure:

CAS RN: 66203-03-0
CAS Name: 1-[4,7-dimethoxy-6-[3-(1-piperidinyl)propoxy]-5-benzofuranyl]-3-methylurea
OPENEYE Name: 1-[4,7-dimethoxy-6-[3-(1-piperidyl)propoxy]benzofuran-5-yl]-3-methyl-urea
IUPAC Name: 1-[4,7-dimethoxy-6-(3-piperidin-1-ylpropoxy)-1-benzofuran-5-yl]-3-methylurea
SYSTEMATIC NAME: 1-[4,7-dimethoxy-6-(3-piperidin-1-ylpropoxy)-1-benzofuran-5-yl]-3-methyl-urea
MOLECULAR FORMULA: C20H29N3O5
MOLECULAR WEIGHT: 391.46136
SMILES: CNC(=O)NC1=C(C2=C(C(=C1OCCCN3CCCCC3)OC)OC=C2)OC
Structure:

CAS RN: 66203-02-9
CAS Name: 1-[6-[2-(1-azocanyl)ethoxy]-4,7-dimethoxy-5-benzofuranyl]-3-methylurea
OPENEYE Name: 1-[6-[2-(azocan-1-yl)ethoxy]-4,7-dimethoxy-benzofuran-5-yl]-3-methyl-urea
IUPAC Name: 1-[6-[2-(azocan-1-yl)ethoxy]-4,7-dimethoxy-1-benzofuran-5-yl]-3-methylurea
SYSTEMATIC NAME: 1-[6-[2-(azocan-1-yl)ethoxy]-4,7-dimethoxy-1-benzofuran-5-yl]-3-methyl-urea
MOLECULAR FORMULA: C21H31N3O5
MOLECULAR WEIGHT: 405.48794
SMILES: CNC(=O)NC1=C(C2=C(C(=C1OCCN3CCCCCCC3)OC)OC=C2)OC
Structure:

CAS RN: 66203-01-8
CAS Name: 1-[6-[2-(1-azepanyl)ethoxy]-4,7-dimethoxy-5-benzofuranyl]-3-methylurea
OPENEYE Name: 1-[6-[2-(azepan-1-yl)ethoxy]-4,7-dimethoxy-benzofuran-5-yl]-3-methyl-urea
IUPAC Name: 1-[6-[2-(azepan-1-yl)ethoxy]-4,7-dimethoxy-1-benzofuran-5-yl]-3-methylurea
SYSTEMATIC NAME: 1-[6-[2-(azepan-1-yl)ethoxy]-4,7-dimethoxy-1-benzofuran-5-yl]-3-methyl-urea
MOLECULAR FORMULA: C20H29N3O5
MOLECULAR WEIGHT: 391.46136
SMILES: CNC(=O)NC1=C(C2=C(C(=C1OCCN3CCCCCC3)OC)OC=C2)OC
Structure:

CAS RN: 66202-99-1
CAS Name: 1-[6-[2-(diethylamino)ethoxy]-4,7-dimethoxy-5-benzofuranyl]-3-methylurea
OPENEYE Name: 1-[6-[2-(diethylamino)ethoxy]-4,7-dimethoxy-benzofuran-5-yl]-3-methyl-urea
IUPAC Name: 1-[6-[2-(diethylamino)ethoxy]-4,7-dimethoxy-1-benzofuran-5-yl]-3-methylurea
SYSTEMATIC NAME: 1-[6-[2-(diethylamino)ethoxy]-4,7-dimethoxy-1-benzofuran-5-yl]-3-methyl-urea
MOLECULAR FORMULA: C18H27N3O5
MOLECULAR WEIGHT: 365.42408
SMILES: CCN(CC)CCOC1=C(C2=C(C=CO2)C(=C1NC(=O)NC)OC)OC
Structure:

CAS RN: 66202-98-0
CAS Name: 1-[6-[2-(dimethylamino)ethoxy]-4,7-dimethoxy-5-benzofuranyl]-3-methylurea
OPENEYE Name: 1-[6-[2-(dimethylamino)ethoxy]-4,7-dimethoxy-benzofuran-5-yl]-3-methyl-urea
IUPAC Name: 1-[6-[2-(dimethylamino)ethoxy]-4,7-dimethoxy-1-benzofuran-5-yl]-3-methylurea
SYSTEMATIC NAME: 1-[6-[2-(dimethylamino)ethoxy]-4,7-dimethoxy-1-benzofuran-5-yl]-3-methyl-urea
MOLECULAR FORMULA: C16H23N3O5
MOLECULAR WEIGHT: 337.37092
SMILES: CNC(=O)NC1=C(C2=C(C(=C1OCCN(C)C)OC)OC=C2)OC
Structure:

CAS RN: 66202-97-9
CAS Name: 1-[4,7-dimethoxy-6-[2-(1-piperidinyl)ethoxy]-5-benzofuranyl]-3-ethylurea
OPENEYE Name: 1-[4,7-dimethoxy-6-[2-(1-piperidyl)ethoxy]benzofuran-5-yl]-3-ethyl-urea
IUPAC Name: 1-[4,7-dimethoxy-6-(2-piperidin-1-ylethoxy)-1-benzofuran-5-yl]-3-ethylurea
SYSTEMATIC NAME: 1-[4,7-dimethoxy-6-(2-piperidin-1-ylethoxy)-1-benzofuran-5-yl]-3-ethyl-urea
MOLECULAR FORMULA: C20H29N3O5
MOLECULAR WEIGHT: 391.46136
SMILES: CCNC(=O)NC1=C(C2=C(C(=C1OCCN3CCCCC3)OC)OC=C2)OC
Structure:

CAS RN: 66195-04-8
CAS Name: 3-(phenylmethyl)pyrrolidine-2,5-dione
OPENEYE Name: 3-benzylpyrrolidine-2,5-dione
IUPAC Name: 3-benzylpyrrolidine-2,5-dione
SYSTEMATIC NAME: 3-(phenylmethyl)pyrrolidine-2,5-dione
MOLECULAR FORMULA: C11H11NO2
MOLECULAR WEIGHT: 189.21054
SMILES: C1C(C(=O)NC1=O)CC2=CC=CC=C2
Structure:

CAS RN: 66186-09-2
CAS Name: 1-ethyl-3-phenylpyrrolidine-2,5-dione
OPENEYE Name: 1-ethyl-3-phenyl-pyrrolidine-2,5-dione
IUPAC Name: 1-ethyl-3-phenylpyrrolidine-2,5-dione
SYSTEMATIC NAME: 1-ethyl-3-phenyl-pyrrolidine-2,5-dione
MOLECULAR FORMULA: C12H13NO2
MOLECULAR WEIGHT: 203.23712
SMILES: CCN1C(=O)CC(C1=O)C2=CC=CC=C2
Structure:

CAS RN: 66181-62-2
CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)piperazine; 4-butyl-1-phenyl-2-(4-phenyl-2-thiazolyl)pyrazolidine-3,5-dione
OPENEYE Name: 1-(1,3-benzodioxol-5-ylmethyl)piperazine; 4-butyl-1-phenyl-2-(4-phenylthiazol-2-yl)pyrazolidine-3,5-dione
IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)piperazine; 4-butyl-1-phenyl-2-(4-phenyl-1,3-thiazol-2-yl)pyrazolidine-3,5-dione
SYSTEMATIC NAME: 1-(1,3-benzodioxol-5-ylmethyl)piperazine; 4-butyl-1-phenyl-2-(4-phenyl-1,3-thiazol-2-yl)pyrazolidine-3,5-dione
MOLECULAR FORMULA: C34H37N5O4S
MOLECULAR WEIGHT: 611.75368
SMILES: CCCCC1C(=O)N(N(C1=O)C2=NC(=CS2)C3=CC=CC=C3)C4=CC=CC=C4.C1CN(CCN1)CC2=CC3=C(C=C2)OCO3
Structure:

CAS RN: 66181-61-1
CAS Name: 4-butyl-1-phenyl-2-(4-phenyl-2-thiazolyl)pyrazolidine-3,5-dione; piperazine
OPENEYE Name: 4-butyl-1-phenyl-2-(4-phenylthiazol-2-yl)pyrazolidine-3,5-dione; piperazine
IUPAC Name: 4-butyl-1-phenyl-2-(4-phenyl-1,3-thiazol-2-yl)pyrazolidine-3,5-dione; piperazine
SYSTEMATIC NAME: 4-butyl-1-phenyl-2-(4-phenyl-1,3-thiazol-2-yl)pyrazolidine-3,5-dione; piperazine
MOLECULAR FORMULA: C26H31N5O2S
MOLECULAR WEIGHT: 477.62164
SMILES: CCCCC1C(=O)N(N(C1=O)C2=NC(=CS2)C3=CC=CC=C3)C4=CC=CC=C4.C1CNCCN1
Structure:

CAS RN: 66181-60-0
CAS Name: 4-butyl-1-phenyl-2-(4-phenyl-2-thiazolyl)pyrazolidine-3,5-dione; 1-(2-pyridinyl)piperazine
OPENEYE Name: 4-butyl-1-phenyl-2-(4-phenylthiazol-2-yl)pyrazolidine-3,5-dione; 1-(2-pyridyl)piperazine
IUPAC Name: 4-butyl-1-phenyl-2-(4-phenyl-1,3-thiazol-2-yl)pyrazolidine-3,5-dione; 1-pyridin-2-ylpiperazine
SYSTEMATIC NAME: 4-butyl-1-phenyl-2-(4-phenyl-1,3-thiazol-2-yl)pyrazolidine-3,5-dione; 1-pyridin-2-ylpiperazine
MOLECULAR FORMULA: C31H34N6O2S
MOLECULAR WEIGHT: 554.70566
SMILES: CCCCC1C(=O)N(N(C1=O)C2=NC(=CS2)C3=CC=CC=C3)C4=CC=CC=C4.C1CN(CCN1)C2=CC=CC=N2
Structure:

CAS RN: 66178-06-1
CAS Name: (2S)-2-hydroxy-4-oxo-4-phenylmethoxybutanoic acid
OPENEYE Name: (2S)-4-benzyloxy-2-hydroxy-4-oxo-butanoic acid
IUPAC Name: (2S)-2-hydroxy-4-oxo-4-phenylmethoxybutanoic acid
SYSTEMATIC NAME: (2S)-2-oxidanyl-4-oxidanylidene-4-phenylmethoxy-butanoic acid
MOLECULAR FORMULA: C11H12O5
MOLECULAR WEIGHT: 224.20998
SMILES: C1=CC=C(C=C1)COC(=O)C[C@@H](C(=O)O)O
Structure:

CAS RN: 66176-44-1
CAS Name: 3-(4-chlorophenyl)-1,3,4,6,7,8,9,9a-octahydropyrido[2,1-c][1,4]oxazine hydrochloride
OPENEYE Name: 3-(4-chlorophenyl)-1,3,4,6,7,8,9,9a-octahydropyrido[2,1-c][1,4]oxazine hydrochloride
IUPAC Name: 3-(4-chlorophenyl)-1,3,4,6,7,8,9,9a-octahydropyrido[2,1-c][1,4]oxazine hydrochloride
SYSTEMATIC NAME: 3-(4-chlorophenyl)-1,3,4,6,7,8,9,9a-octahydropyrido[2,1-c][1,4]oxazine hydrochloride
MOLECULAR FORMULA: C14H19Cl2NO
MOLECULAR WEIGHT: 288.21276
SMILES: C1CCN2CC(OCC2C1)C3=CC=C(C=C3)Cl.Cl
Structure:

CAS RN: 66171-58-2
CAS Name: (2S)-2-aminopropanoic acid [1-(4-methoxyphenyl)-2-methylpropan-2-yl] ester hydrochloride
OPENEYE Name: [2-(4-methoxyphenyl)-1,1-dimethyl-ethyl] (2S)-2-aminopropanoate hydrochloride
IUPAC Name: [1-(4-methoxyphenyl)-2-methylpropan-2-yl] (2S)-2-aminopropanoate hydrochloride
SYSTEMATIC NAME: [1-(4-methoxyphenyl)-2-methyl-propan-2-yl] (2S)-2-azanylpropanoate hydrochloride
MOLECULAR FORMULA: C14H22ClNO3
MOLECULAR WEIGHT: 287.78238
SMILES: C[C@@H](C(=O)OC(C)(C)CC1=CC=C(C=C1)OC)N.Cl
Structure:

CAS RN: 66170-58-9
CAS Name: 3-[4-(trifluoromethyl)phenyl]-4,6,7,8,9,9a-hexahydro-1H-pyrido[2,1-c][1,4]oxazin-3-ol hydrochloride
OPENEYE Name: 3-[4-(trifluoromethyl)phenyl]-4,6,7,8,9,9a-hexahydro-1H-pyrido[2,1-c][1,4]oxazin-3-ol hydrochloride
IUPAC Name: 3-[4-(trifluoromethyl)phenyl]-4,6,7,8,9,9a-hexahydro-1H-pyrido[2,1-c][1,4]oxazin-3-ol hydrochloride
SYSTEMATIC NAME: 3-[4-(trifluoromethyl)phenyl]-4,6,7,8,9,9a-hexahydro-1H-pyrido[2,1-c][1,4]oxazin-3-ol hydrochloride
MOLECULAR FORMULA: C15H19ClF3NO2
MOLECULAR WEIGHT: 337.76507
SMILES: C1CCN2CC(OCC2C1)(C3=CC=C(C=C3)C(F)(F)F)O.Cl
Structure:

CAS RN: 66170-25-0
CAS Name: 2-[(dimethylamino)methyl]-1-phenyl-1-cyclohexanol hydrochloride
OPENEYE Name: 2-[(dimethylamino)methyl]-1-phenyl-cyclohexanol hydrochloride
IUPAC Name: 2-[(dimethylamino)methyl]-1-phenylcyclohexan-1-ol hydrochloride
SYSTEMATIC NAME: 2-[(dimethylamino)methyl]-1-phenyl-cyclohexan-1-ol hydrochloride
MOLECULAR FORMULA: C15H24ClNO
MOLECULAR WEIGHT: 269.81016
SMILES: CN(C)CC1CCCCC1(C2=CC=CC=C2)O.Cl
Structure:

CAS RN: 66170-21-6
CAS Name: 2-[[bis(phenylmethyl)amino]methyl]-1-(3-methoxyphenyl)-1-cyclohexanol hydrochloride
OPENEYE Name: 2-[(dibenzylamino)methyl]-1-(3-methoxyphenyl)cyclohexanol hydrochloride
IUPAC Name: 2-[(dibenzylamino)methyl]-1-(3-methoxyphenyl)cyclohexan-1-ol hydrochloride
SYSTEMATIC NAME: 2-[[bis(phenylmethyl)amino]methyl]-1-(3-methoxyphenyl)cyclohexan-1-ol hydrochloride
MOLECULAR FORMULA: C28H34ClNO2
MOLECULAR WEIGHT: 452.02806
SMILES: COC1=CC=CC(=C1)C2(CCCCC2CN(CC3=CC=CC=C3)CC4=CC=CC=C4)O.Cl
Structure:

CAS RN: 66170-04-5
CAS Name: 1,1,1-trichloro-3-(6,7-dimethoxy-1-isoquinolinyl)-3-(3,4-dimethoxyphenyl)-2-propanone
OPENEYE Name: 1,1,1-trichloro-3-(6,7-dimethoxy-1-isoquinolyl)-3-(3,4-dimethoxyphenyl)propan-2-one
IUPAC Name: 1,1,1-trichloro-3-(6,7-dimethoxyisoquinolin-1-yl)-3-(3,4-dimethoxyphenyl)propan-2-one
SYSTEMATIC NAME: 1,1,1-tris(chloranyl)-3-(6,7-dimethoxyisoquinolin-1-yl)-3-(3,4-dimethoxyphenyl)propan-2-one
MOLECULAR FORMULA: C22H20Cl3NO5
MOLECULAR WEIGHT: 484.7569
SMILES: COC1=C(C=C(C=C1)C(C2=NC=CC3=CC(=C(C=C32)OC)OC)C(=O)C(Cl)(Cl)Cl)OC
Structure:

CAS RN: 66170-03-4
CAS Name: 3-chloro-1-(6,7-dimethoxy-1-isoquinolinyl)-1-(3,4-dimethoxyphenyl)-2-propanone
OPENEYE Name: 3-chloro-1-(6,7-dimethoxy-1-isoquinolyl)-1-(3,4-dimethoxyphenyl)propan-2-one
IUPAC Name: 3-chloro-1-(6,7-dimethoxyisoquinolin-1-yl)-1-(3,4-dimethoxyphenyl)propan-2-one
SYSTEMATIC NAME: 3-chloranyl-1-(6,7-dimethoxyisoquinolin-1-yl)-1-(3,4-dimethoxyphenyl)propan-2-one
MOLECULAR FORMULA: C22H22ClNO5
MOLECULAR WEIGHT: 415.86678
SMILES: COC1=C(C=C(C=C1)C(C2=NC=CC3=CC(=C(C=C32)OC)OC)C(=O)CCl)OC
Structure:

CAS RN: 66156-63-6
CAS Name: 1-methyl-2-(prop-2-ynylthio)benzimidazole hydrobromide
OPENEYE Name: 1-methyl-2-prop-2-ynylsulfanyl-benzimidazole hydrobromide
IUPAC Name: 1-methyl-2-prop-2-ynylsulfanylbenzimidazole hydrobromide
SYSTEMATIC NAME: 1-methyl-2-prop-2-ynylsulfanyl-benzimidazole hydrobromide
MOLECULAR FORMULA: C11H11BrN2S
MOLECULAR WEIGHT: 283.18744
SMILES: CN1C2=CC=CC=C2N=C1SCC#C.Br
Structure:

CAS RN: 66156-62-5
CAS Name: 1-methyl-2-(prop-2-ynylthio)imidazole hydrobromide
OPENEYE Name: 1-methyl-2-prop-2-ynylsulfanyl-imidazole hydrobromide
IUPAC Name: 1-methyl-2-prop-2-ynylsulfanylimidazole hydrobromide
SYSTEMATIC NAME: 1-methyl-2-prop-2-ynylsulfanyl-imidazole hydrobromide
MOLECULAR FORMULA: C7H9BrN2S
MOLECULAR WEIGHT: 233.12876
SMILES: CN1C=CN=C1SCC#C.Br
Structure:

CAS RN: 66147-53-3
CAS Name: 3-[4-[(3-acetamido-9-acridinyl)amino]phenyl]propanoic acid hydrochloride
OPENEYE Name: 3-[4-[(3-acetamidoacridin-9-yl)amino]phenyl]propanoic acid hydrochloride
IUPAC Name: 3-[4-[(3-acetamidoacridin-9-yl)amino]phenyl]propanoic acid hydrochloride
SYSTEMATIC NAME: 3-[4-[(3-acetamidoacridin-9-yl)amino]phenyl]propanoic acid hydrochloride
MOLECULAR FORMULA: C24H22ClN3O3
MOLECULAR WEIGHT: 435.90278
SMILES: CC(=O)NC1=CC2=NC3=CC=CC=C3C(=C2C=C1)NC4=CC=C(C=C4)CCC(=O)O.Cl
Structure:

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