CAS RN: 151204-56-7
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C16H19NO4
MOLECULAR WEIGHT: 289.32636
SMILES: C1C[C@@H]2[C@@]3(CCN2CC4=CC5=C(C=C43)OCO5)[C@@H]([C@@H]1O)O
Structure:
CAS RN: 115994-31-5
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C16H19NO3
MOLECULAR WEIGHT: 273.32696
SMILES: COC1=C(C=C2CN3CCC4=CC[C@H]([C@H]([C@H]43)C2=C1)O)O
Structure:
CAS RN: 5137-36-0
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C16H17NO4
MOLECULAR WEIGHT: 287.31048
SMILES: C1CN2CC3=CC4=C(C=C3[C@]15[C@H]2C[C@H]([C@H]6[C@@H]5O6)O)OCO4
Structure:
CAS RN: 2232-49-7
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C21H23NO4
MOLECULAR WEIGHT: 353.41162
SMILES: CN1CCC2=CC(=C(C3=C4C=C(C(=CC4=CC1=C23)OC)OC)OC)OC
Structure:
CAS RN: 13356-20-2
CAS Name: 1,5,9-trimethyl-1,5,9-triazacyclododecane
OPENEYE Name: 1,5,9-trimethyl-1,5,9-triazacyclododecane
IUPAC Name: 1,5,9-trimethyl-1,5,9-triazacyclododecane
SYSTEMATIC NAME: 1,5,9-trimethyl-1,5,9-triazacyclododecane
MOLECULAR FORMULA: C12H27N3
MOLECULAR WEIGHT: 213.36288
SMILES: CN1CCCN(CCCN(CCC1)C)C
Structure:
CAS RN: 36815-43-7
CAS Name: 1,4,8-triazacycloundecane
OPENEYE Name: 1,4,8-triazacycloundecane
IUPAC Name: 1,4,8-triazacycloundecane
SYSTEMATIC NAME: 1,4,8-triazacycloundecane
MOLECULAR FORMULA: C8H19N3
MOLECULAR WEIGHT: 157.25656
SMILES: C1CNCCCNCCNC1
Structure:
CAS RN: 199852-48-7
CAS Name: 3-(bromomethyl)-5-[(3,5-dimethylphenyl)methyl]-6-ethyl-2,3-dihydrothiazolo[3,2-a]pyrimidin-7-one
OPENEYE Name: 3-(bromomethyl)-5-[(3,5-dimethylphenyl)methyl]-6-ethyl-2,3-dihydrothiazolo[3,2-a]pyrimidin-7-one
IUPAC Name: 3-(bromomethyl)-5-[(3,5-dimethylphenyl)methyl]-6-ethyl-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidin-7-one
SYSTEMATIC NAME: 3-(bromomethyl)-5-[(3,5-dimethylphenyl)methyl]-6-ethyl-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidin-7-one
MOLECULAR FORMULA: C18H21BrN2OS
MOLECULAR WEIGHT: 393.34114
SMILES: CCC1=C(N2C(CSC2=NC1=O)CBr)CC3=CC(=CC(=C3)C)C
Structure:
CAS RN: 199852-30-7
CAS Name: 6-ethyl-3-(2-hydroxyethoxy)-5-(1-naphthalenylmethyl)-2,3-dihydrothiazolo[3,2-a]pyrimidin-7-one
OPENEYE Name: 6-ethyl-3-(2-hydroxyethoxy)-5-(1-naphthylmethyl)-2,3-dihydrothiazolo[3,2-a]pyrimidin-7-one
IUPAC Name: 6-ethyl-3-(2-hydroxyethoxy)-5-(naphthalen-1-ylmethyl)-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidin-7-one
SYSTEMATIC NAME: 6-ethyl-3-(2-hydroxyethyloxy)-5-(naphthalen-1-ylmethyl)-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidin-7-one
MOLECULAR FORMULA: C21H22N2O3S
MOLECULAR WEIGHT: 382.47598
SMILES: CCC1=C(N2C(CSC2=NC1=O)OCCO)CC3=CC=CC4=CC=CC=C43
Structure:
CAS RN: 41805-36-1
CAS Name: [1-(1-piperidinyl)cyclohexyl]methanamine
OPENEYE Name: [1-(1-piperidyl)cyclohexyl]methanamine
IUPAC Name: (1-piperidin-1-ylcyclohexyl)methanamine
SYSTEMATIC NAME: (1-piperidin-1-ylcyclohexyl)methanamine
MOLECULAR FORMULA: C12H24N2
MOLECULAR WEIGHT: 196.33236
SMILES: C1CCC(CC1)(CN)N2CCCCC2
Structure:
CAS RN: 65674-07-9
CAS Name: bis[4-(dimethylamino)phenyl]methanone hydrazone
OPENEYE Name: bis[4-(dimethylamino)phenyl]methanone hydrazone
IUPAC Name: 4-[C-[4-(dimethylamino)phenyl]carbonohydrazonoyl]-N,N-dimethylaniline
SYSTEMATIC NAME: 4-[C-[4-(dimethylamino)phenyl]carbonohydrazonoyl]-N,N-dimethyl-aniline
MOLECULAR FORMULA: C17H22N4
MOLECULAR WEIGHT: 282.38338
SMILES: CN(C)C1=CC=C(C=C1)C(=NN)C2=CC=C(C=C2)N(C)C
Structure:
CAS RN: 599-85-9
CAS Name: (3S,4aR,6aR,6bS,8S,8aS,12aS,14aR,14bR)-4,4,6a,6b,8a,11,11,14b-octamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicene-3,8-diol
OPENEYE Name: (3S,4aR,6aR,6bS,8S,8aS,12aS,14aR,14bR)-4,4,6a,6b,8a,11,11,14b-octamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicene-3,8-diol
IUPAC Name: (3S,4aR,6aR,6bS,8S,8aS,12aS,14aR,14bR)-4,4,6a,6b,8a,11,11,14b-octamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicene-3,8-diol
SYSTEMATIC NAME: (3S,4aR,6aR,6bS,8S,8aS,12aS,14aR,14bR)-4,4,6a,6b,8a,11,11,14b-octamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicene-3,8-diol
MOLECULAR FORMULA: C30H50O2
MOLECULAR WEIGHT: 442.7168
SMILES: C[C@]12CC[C@@H](C([C@@H]1CC[C@@]3([C@@H]2CC=C4[C@]3(C[C@@H]([C@@]5([C@H]4CC(CC5)(C)C)C)O)C)C)(C)C)O
Structure:
CAS RN: 308246-52-8
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C24H24N2O7
MOLECULAR WEIGHT: 452.45656
SMILES: COC1=C(C=C2C(=C1)C3=C(C4=CC5=C(C=C4C3=O)OCO5)N(C2=O)CCCNCCO)OC
Structure:
CAS RN: 13407-03-9
CAS Name: 2-methyl-1,3,2$l^{5}-dioxaphosphorinane 2-oxide
OPENEYE Name: 2-methyl-1,3,2$l^{5}-dioxaphosphinane 2-oxide
IUPAC Name: 2-methyl-1,3,2$l^{5}-dioxaphosphinane 2-oxide
SYSTEMATIC NAME: 2-methyl-1,3,2$l^{5}-dioxaphosphinane 2-oxide
MOLECULAR FORMULA: C4H9O3P
MOLECULAR WEIGHT: 136.086221
SMILES: CP1(=O)OCCCO1
Structure:
CAS RN: 89524-98-1
CAS Name: 2-dimethoxyphosphoryl-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]acetic acid methyl ester
OPENEYE Name: methyl 2-(tert-butoxycarbonylamino)-2-dimethoxyphosphoryl-acetate
IUPAC Name: methyl 2-dimethoxyphosphoryl-2-[(2-methylpropan-2-yl)oxycarbonylamino]acetate
SYSTEMATIC NAME: methyl 2-dimethoxyphosphoryl-2-[(2-methylpropan-2-yl)oxycarbonylamino]ethanoate
MOLECULAR FORMULA: C10H20NO7P
MOLECULAR WEIGHT: 297.242061
SMILES: CC(C)(C)OC(=O)NC(C(=O)OC)P(=O)(OC)OC
Structure:
CAS RN: 500576-09-0
CAS Name: 9-(3-methylbutyl)-3-methylene-1,5-bis-(4-methylphenyl)sulfonyl-1,5,9-triazacyclododecane
OPENEYE Name: 9-isopentyl-3-methylene-1,5-bis(p-tolylsulfonyl)-1,5,9-triazacyclododecane
IUPAC Name: 9-(3-methylbutyl)-3-methylidene-1,5-bis-(4-methylphenyl)sulfonyl-1,5,9-triazacyclododecane
SYSTEMATIC NAME: 9-(3-methylbutyl)-3-methylidene-1,5-bis-(4-methylphenyl)sulfonyl-1,5,9-triazacyclododecane
MOLECULAR FORMULA: C29H43N3O4S2
MOLECULAR WEIGHT: 561.79942
SMILES: CC1=CC=C(C=C1)S(=O)(=O)N2CCCN(CCCN(CC(=C)C2)S(=O)(=O)C3=CC=C(C=C3)C)CCC(C)C
Structure:
CAS RN: 135-37-5
CAS Name: (8S,10S,13S,14S,16S,17R)-17-hydroxy-17-(2-hydroxy-1-oxoethyl)-10,13,16-trimethyl-7,8,12,14,15,16-hexahydro-6H-cyclopenta[a]phenanthren-3-one
OPENEYE Name: (8S,10S,13S,14S,16S,17R)-17-hydroxy-17-(2-hydroxyacetyl)-10,13,16-trimethyl-7,8,12,14,15,16-hexahydro-6H-cyclopenta[a]phenanthren-3-one
IUPAC Name: (8S,10S,13S,14S,16S,17R)-17-hydroxy-17-(2-hydroxyacetyl)-10,13,16-trimethyl-7,8,12,14,15,16-hexahydro-6H-cyclopenta[a]phenanthren-3-one
SYSTEMATIC NAME: (8S,10S,13S,14S,16S,17R)-10,13,16-trimethyl-17-oxidanyl-17-(2-oxidanylethanoyl)-7,8,12,14,15,16-hexahydro-6H-cyclopenta[a]phenanthren-3-one
MOLECULAR FORMULA: C22H28O4
MOLECULAR WEIGHT: 356.45532
SMILES: C[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@@]4(C3=CC[C@@]2([C@]1(C(=O)CO)O)C)C
Structure:
CAS RN: 34687-42-8
CAS Name: (3S,4S)-3-hydroxy-3,4-bis[(4-hydroxy-3-methoxyphenyl)methyl]-2-oxolanone
OPENEYE Name: (3S,4S)-3-hydroxy-3,4-bis[(4-hydroxy-3-methoxy-phenyl)methyl]tetrahydrofuran-2-one
IUPAC Name: (3S,4S)-3-hydroxy-3,4-bis[(4-hydroxy-3-methoxyphenyl)methyl]oxolan-2-one
SYSTEMATIC NAME: (3S,4S)-3,4-bis[(3-methoxy-4-oxidanyl-phenyl)methyl]-3-oxidanyl-oxolan-2-one
MOLECULAR FORMULA: C20H22O7
MOLECULAR WEIGHT: 374.38448
SMILES: COC1=C(C=CC(=C1)C[C@H]2COC(=O)[C@@]2(CC3=CC(=C(C=C3)O)OC)O)O
Structure:
CAS RN: 34444-37-6
CAS Name: (3S,4S)-3-hydroxy-3,4-bis[(4-hydroxy-3-methoxyphenyl)methyl]-2-oxolanone
OPENEYE Name: (3S,4S)-3-hydroxy-3,4-bis[(4-hydroxy-3-methoxy-phenyl)methyl]tetrahydrofuran-2-one
IUPAC Name: (3S,4S)-3-hydroxy-3,4-bis[(4-hydroxy-3-methoxyphenyl)methyl]oxolan-2-one
SYSTEMATIC NAME: (3S,4S)-3,4-bis[(3-methoxy-4-oxidanyl-phenyl)methyl]-3-oxidanyl-oxolan-2-one
MOLECULAR FORMULA: C20H22O7
MOLECULAR WEIGHT: 374.38448
SMILES: COC1=C(C=CC(=C1)C[C@H]2COC(=O)[C@@]2(CC3=CC(=C(C=C3)O)OC)O)O
Structure:
CAS RN: 4742-89-6
CAS Name: 1-nitro-2-[2-(2-nitrophenoxy)ethoxy]benzene
OPENEYE Name: 1-nitro-2-[2-(2-nitrophenoxy)ethoxy]benzene
IUPAC Name: 1-nitro-2-[2-(2-nitrophenoxy)ethoxy]benzene
SYSTEMATIC NAME: 1-nitro-2-[2-(2-nitrophenoxy)ethoxy]benzene
MOLECULAR FORMULA: C14H12N2O6
MOLECULAR WEIGHT: 304.25488
SMILES: C1=CC=C(C(=C1)[N+](=O)[O-])OCCOC2=CC=CC=C2[N+](=O)[O-]
Structure:
CAS RN: 47682-91-7
CAS Name: (3aS,7aS)-3a-(3,4-dimethoxyphenyl)-1-methyl-2,3,4,5,7,7a-hexahydroindol-6-one
OPENEYE Name: (3aS,7aS)-3a-(3,4-dimethoxyphenyl)-1-methyl-2,3,4,5,7,7a-hexahydroindol-6-one
IUPAC Name: (3aS,7aS)-3a-(3,4-dimethoxyphenyl)-1-methyl-2,3,4,5,7,7a-hexahydroindol-6-one
SYSTEMATIC NAME: (3aS,7aS)-3a-(3,4-dimethoxyphenyl)-1-methyl-2,3,4,5,7,7a-hexahydroindol-6-one
MOLECULAR FORMULA: C17H23NO3
MOLECULAR WEIGHT: 289.36942
SMILES: CN1CC[C@]2([C@@H]1CC(=O)CC2)C3=CC(=C(C=C3)OC)OC
Structure:
CAS RN: 24880-43-1
CAS Name: (3aS,7aS)-3a-(3,4-dimethoxyphenyl)-1-methyl-2,3,4,5,7,7a-hexahydroindol-6-one
OPENEYE Name: (3aS,7aS)-3a-(3,4-dimethoxyphenyl)-1-methyl-2,3,4,5,7,7a-hexahydroindol-6-one
IUPAC Name: (3aS,7aS)-3a-(3,4-dimethoxyphenyl)-1-methyl-2,3,4,5,7,7a-hexahydroindol-6-one
SYSTEMATIC NAME: (3aS,7aS)-3a-(3,4-dimethoxyphenyl)-1-methyl-2,3,4,5,7,7a-hexahydroindol-6-one
MOLECULAR FORMULA: C17H23NO3
MOLECULAR WEIGHT: 289.36942
SMILES: CN1CC[C@]2([C@@H]1CC(=O)CC2)C3=CC(=C(C=C3)OC)OC
Structure:
CAS RN: 113811-45-3
CAS Name: [[[4-[(2,4-diamino-6-pteridinyl)methyl-methylamino]phenyl]-oxomethyl]amino]methanesulfonic acid
OPENEYE Name: [[4-[(2,4-diaminopteridin-6-yl)methyl-methyl-amino]benzoyl]amino]methanesulfonic acid
IUPAC Name: [[4-[(2,4-diaminopteridin-6-yl)methyl-methylamino]benzoyl]amino]methanesulfonic acid
SYSTEMATIC NAME: [[4-[[2,4-bis(azanyl)pteridin-6-yl]methyl-methyl-amino]phenyl]carbonylamino]methanesulfonic acid
MOLECULAR FORMULA: C16H18N8O4S
MOLECULAR WEIGHT: 418.43032
SMILES: CN(CC1=CN=C2C(=N1)C(=NC(=N2)N)N)C3=CC=C(C=C3)C(=O)NCS(=O)(=O)O
Structure:
CAS RN: 114119-93-6
CAS Name: [[[4-[(2,4-diamino-6-pteridinyl)methyl-methylamino]phenyl]-oxomethyl]amino]methanesulfonic acid
OPENEYE Name: [[4-[(2,4-diaminopteridin-6-yl)methyl-methyl-amino]benzoyl]amino]methanesulfonic acid
IUPAC Name: [[4-[(2,4-diaminopteridin-6-yl)methyl-methylamino]benzoyl]amino]methanesulfonic acid
SYSTEMATIC NAME: [[4-[[2,4-bis(azanyl)pteridin-6-yl]methyl-methyl-amino]phenyl]carbonylamino]methanesulfonic acid
MOLECULAR FORMULA: C16H18N8O4S
MOLECULAR WEIGHT: 418.43032
SMILES: CN(CC1=CN=C2C(=N1)C(=NC(=N2)N)N)C3=CC=C(C=C3)C(=O)NCS(=O)(=O)O
Structure:
CAS RN: 90081-15-5
CAS Name: 2-[[[4-[(2,4-diamino-6-pteridinyl)methyl-methylamino]phenyl]-oxomethyl]amino]-4-sulfobutanoic acid
OPENEYE Name: 2-[[4-[(2,4-diaminopteridin-6-yl)methyl-methyl-amino]benzoyl]amino]-4-sulfo-butanoic acid
IUPAC Name: 2-[[4-[(2,4-diaminopteridin-6-yl)methyl-methylamino]benzoyl]amino]-4-sulfobutanoic acid
SYSTEMATIC NAME: 2-[[4-[[2,4-bis(azanyl)pteridin-6-yl]methyl-methyl-amino]phenyl]carbonylamino]-4-sulfo-butanoic acid
MOLECULAR FORMULA: C19H22N8O6S
MOLECULAR WEIGHT: 490.49298
SMILES: CN(CC1=CN=C2C(=N1)C(=NC(=N2)N)N)C3=CC=C(C=C3)C(=O)NC(CCS(=O)(=O)O)C(=O)O
Structure:
CAS RN: 35875-16-2
CAS Name: 2-(3-carboxyanilino)-3-nitrobenzoic acid
OPENEYE Name: 2-(3-carboxyanilino)-3-nitro-benzoic acid
IUPAC Name: 2-(3-carboxyanilino)-3-nitrobenzoic acid
SYSTEMATIC NAME: 2-[(3-carboxyphenyl)amino]-3-nitro-benzoic acid
MOLECULAR FORMULA: C14H10N2O6
MOLECULAR WEIGHT: 302.239
SMILES: C1=CC(=CC(=C1)NC2=C(C=CC=C2[N+](=O)[O-])C(=O)O)C(=O)O
Structure:
CAS RN: 61063-11-4
CAS Name: 2-amino-3-nitrobenzoic acid ethyl ester
OPENEYE Name: ethyl 2-amino-3-nitro-benzoate
IUPAC Name: ethyl 2-amino-3-nitrobenzoate
SYSTEMATIC NAME: ethyl 2-azanyl-3-nitro-benzoate
MOLECULAR FORMULA: C9H10N2O4
MOLECULAR WEIGHT: 210.1867
SMILES: CCOC(=O)C1=C(C(=CC=C1)[N+](=O)[O-])N
Structure:
CAS RN: 81235-52-1
CAS Name: 3-(4-methoxyphenyl)-1-methyl-2-phenylindolizine
OPENEYE Name: 3-(4-methoxyphenyl)-1-methyl-2-phenyl-indolizine
IUPAC Name: 3-(4-methoxyphenyl)-1-methyl-2-phenylindolizine
SYSTEMATIC NAME: 3-(4-methoxyphenyl)-1-methyl-2-phenyl-indolizine
MOLECULAR FORMULA: C22H19NO
MOLECULAR WEIGHT: 313.39236
SMILES: CC1=C2C=CC=CN2C(=C1C3=CC=CC=C3)C4=CC=C(C=C4)OC
Structure:
CAS RN: 156436-89-4
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C52H72GdN5O14
MOLECULAR WEIGHT: 1148.40318
SMILES: CCC1=C(C2=CC3=NC(=CN=C4C=C(C(=CC4=NC=C5C(=C(C(=N5)C=C1[N-]2)CCCO)C)OCCOCCOCCOC)OCCOCCOCCOC)C(=C3CCCO)C)CC.CC(=O)[O-].CC(=O)[O-].[Gd+3]
Structure:
CAS RN: 5005-40-3
CAS Name: (1-methyl-2-indolyl)-[2-(3-pyridinyl)-1,3-dithian-2-yl]methanol
OPENEYE Name: (1-methylindol-2-yl)-[2-(3-pyridyl)-1,3-dithian-2-yl]methanol
IUPAC Name: (1-methylindol-2-yl)-(2-pyridin-3-yl-1,3-dithian-2-yl)methanol
SYSTEMATIC NAME: (1-methylindol-2-yl)-(2-pyridin-3-yl-1,3-dithian-2-yl)methanol
MOLECULAR FORMULA: C19H20N2OS2
MOLECULAR WEIGHT: 356.5049
SMILES: CN1C2=CC=CC=C2C=C1C(C3(SCCCS3)C4=CN=CC=C4)O
Structure:
CAS RN: 173908-58-2
CAS Name: 1-[5-chloro-2-(1-oxopropylamino)phenyl]sulfonyl-2-pyrrolecarboxylic acid ethyl ester
OPENEYE Name: ethyl 1-[5-chloro-2-(propanoylamino)phenyl]sulfonylpyrrole-2-carboxylate
IUPAC Name: ethyl 1-[5-chloro-2-(propanoylamino)phenyl]sulfonylpyrrole-2-carboxylate
SYSTEMATIC NAME: ethyl 1-[5-chloranyl-2-(propanoylamino)phenyl]sulfonylpyrrole-2-carboxylate
MOLECULAR FORMULA: C16H17ClN2O5S
MOLECULAR WEIGHT: 384.83458
SMILES: CCC(=O)NC1=C(C=C(C=C1)Cl)S(=O)(=O)N2C=CC=C2C(=O)OCC
Structure:
CAS RN: 23432-62-4
CAS Name: (6aS)-3-[3-[[(6aS)-2-methoxy-8-methylene-11-oxo-7,9-dihydro-6aH-pyrrolo[2,1-c][1,4]benzodiazepin-3-yl]oxy]propoxy]-2-methoxy-8-methylene-7,9-dihydro-6aH-pyrrolo[2,1-c][1,4]benzodiazepin-11-one
OPENEYE Name: (6aS)-3-[3-[[(6aS)-2-methoxy-8-methylene-11-oxo-7,9-dihydro-6aH-pyrrolo[2,1-c][1,4]benzodiazepin-3-yl]oxy]propoxy]-2-methoxy-8-methylene-7,9-dihydro-6aH-pyrrolo[2,1-c][1,4]benzodiazepin-11-one
IUPAC Name: (6aS)-3-[3-[[(6aS)-2-methoxy-8-methylidene-11-oxo-7,9-dihydro-6aH-pyrrolo[2,1-c][1,4]benzodiazepin-3-yl]oxy]propoxy]-2-methoxy-8-methylidene-7,9-dihydro-6aH-pyrrolo[2,1-c][1,4]benzodiazepin-11-one
SYSTEMATIC NAME: (6aS)-3-[3-[[(6aS)-2-methoxy-8-methylidene-11-oxidanylidene-7,9-dihydro-6aH-pyrrolo[2,1-c][1,4]benzodiazepin-3-yl]oxy]propoxy]-2-methoxy-8-methylidene-7,9-dihydro-6aH-pyrrolo[2,1-c][1,4]benzodiazepin-11-one
MOLECULAR FORMULA: C31H32N4O6
MOLECULAR WEIGHT: 556.60898
SMILES: COC1=C(C=C2C(=C1)C(=O)N3CC(=C)C[C@H]3C=N2)OCCCOC4=C(C=C5C(=C4)N=C[C@@H]6CC(=C)CN6C5=O)OC
Structure:
CAS RN: 142038-96-8
CAS Name: N-(6-hydroxyhexyl)-4-acridinecarboxamide
OPENEYE Name: N-(6-hydroxyhexyl)acridine-4-carboxamide
IUPAC Name: N-(6-hydroxyhexyl)acridine-4-carboxamide
SYSTEMATIC NAME: N-(6-oxidanylhexyl)acridine-4-carboxamide
MOLECULAR FORMULA: C20H22N2O2
MOLECULAR WEIGHT: 322.40088
SMILES: C1=CC=C2C(=C1)C=C3C=CC=C(C3=N2)C(=O)NCCCCCCO
Structure:
CAS RN: 13096-96-3
CAS Name: 4-chloro-1H-indazole
OPENEYE Name: 4-chloro-1H-indazole
IUPAC Name: 4-chloro-1H-indazole
SYSTEMATIC NAME: 4-chloranyl-1H-indazole
MOLECULAR FORMULA: C7H5ClN2
MOLECULAR WEIGHT: 152.581
SMILES: C1=CC2=C(C=NN2)C(=C1)Cl
Structure:
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