CAS RN: 7148-96-1
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C27H34O5
MOLECULAR WEIGHT: 438.55586
SMILES: CC(=O)[C@@]12[C@H](C[C@@H]3[C@@]1(CC[C@H]4[C@H]3CCC5=CC(=O)CC[C@]45C)C)OC(O2)(C)C6=CC=CO6
Structure:
CAS RN: 7099-43-6
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C21H16
MOLECULAR WEIGHT: 268.35174
SMILES: C1CC2=C(C1)C3=CC4=C(C=C3C=C2)C5=CC=CC=C5C=C4
Structure:
CAS RN: 7091-41-0
CAS Name: 3,9-bis(4-methylphenyl)-2,4,8,10-tetraoxa-3,9-diboraspiro[5.5]undecane
OPENEYE Name: 3,9-bis(p-tolyl)-2,4,8,10-tetraoxa-3,9-diboraspiro[5.5]undecane
IUPAC Name: 3,9-bis(4-methylphenyl)-2,4,8,10-tetraoxa-3,9-diboraspiro[5.5]undecane
SYSTEMATIC NAME: 3,9-bis(4-methylphenyl)-2,4,8,10-tetraoxa-3,9-diboraspiro[5.5]undecane
MOLECULAR FORMULA: C19H22B2O4
MOLECULAR WEIGHT: 335.99758
SMILES: B1(OCC2(CO1)COB(OC2)C3=CC=C(C=C3)C)C4=CC=C(C=C4)C
Structure:
CAS RN: 147-63-7
CAS Name: 3-(1-phenylethyl)-4-imidazolecarboxylic acid propyl ester hydrochloride
OPENEYE Name: propyl 3-(1-phenylethyl)imidazole-4-carboxylate hydrochloride
IUPAC Name: propyl 3-(1-phenylethyl)imidazole-4-carboxylate hydrochloride
SYSTEMATIC NAME: propyl 3-(1-phenylethyl)imidazole-4-carboxylate hydrochloride
MOLECULAR FORMULA: C15H19ClN2O2
MOLECULAR WEIGHT: 294.77656
SMILES: CCCOC(=O)C1=CN=CN1C(C)C2=CC=CC=C2.Cl
Structure:
CAS RN: 29755-12-2
CAS Name: 3-(1-phenylethyl)-4-imidazolecarboxylic acid propyl ester hydrochloride
OPENEYE Name: propyl 3-(1-phenylethyl)imidazole-4-carboxylate hydrochloride
IUPAC Name: propyl 3-(1-phenylethyl)imidazole-4-carboxylate hydrochloride
SYSTEMATIC NAME: propyl 3-(1-phenylethyl)imidazole-4-carboxylate hydrochloride
MOLECULAR FORMULA: C15H19ClN2O2
MOLECULAR WEIGHT: 294.77656
SMILES: CCCOC(=O)C1=CN=CN1C(C)C2=CC=CC=C2.Cl
Structure:
CAS RN: 7036-61-5
CAS Name: 3-(1-phenylethyl)-4-imidazolecarboxylic acid propyl ester hydrochloride
OPENEYE Name: propyl 3-(1-phenylethyl)imidazole-4-carboxylate hydrochloride
IUPAC Name: propyl 3-(1-phenylethyl)imidazole-4-carboxylate hydrochloride
SYSTEMATIC NAME: propyl 3-(1-phenylethyl)imidazole-4-carboxylate hydrochloride
MOLECULAR FORMULA: C15H19ClN2O2
MOLECULAR WEIGHT: 294.77656
SMILES: CCCOC(=O)C1=CN=CN1C(C)C2=CC=CC=C2.Cl
Structure:
CAS RN: 6988-20-1
CAS Name: N-methylcarbamic acid [2-(4-methyl-1,3-dioxolan-2-yl)phenyl] ester
OPENEYE Name: [2-(4-methyl-1,3-dioxolan-2-yl)phenyl] N-methylcarbamate
IUPAC Name: [2-(4-methyl-1,3-dioxolan-2-yl)phenyl] N-methylcarbamate
SYSTEMATIC NAME: [2-(4-methyl-1,3-dioxolan-2-yl)phenyl] N-methylcarbamate
MOLECULAR FORMULA: C12H15NO4
MOLECULAR WEIGHT: 237.2518
SMILES: CC1COC(O1)C2=CC=CC=C2OC(=O)NC
Structure:
CAS RN: 6966-09-2
CAS Name: 2-(1-piperidinylmethyl)-1-cyclohexanone
OPENEYE Name: 2-(1-piperidylmethyl)cyclohexanone
IUPAC Name: 2-(piperidin-1-ylmethyl)cyclohexan-1-one
SYSTEMATIC NAME: 2-(piperidin-1-ylmethyl)cyclohexan-1-one
MOLECULAR FORMULA: C12H21NO
MOLECULAR WEIGHT: 195.30124
SMILES: C1CCN(CC1)CC2CCCCC2=O
Structure:
CAS RN: 534-84-9
CAS Name: 2-(1-piperidinylmethyl)-1-cyclohexanone
OPENEYE Name: 2-(1-piperidylmethyl)cyclohexanone
IUPAC Name: 2-(piperidin-1-ylmethyl)cyclohexan-1-one
SYSTEMATIC NAME: 2-(piperidin-1-ylmethyl)cyclohexan-1-one
MOLECULAR FORMULA: C12H21NO
MOLECULAR WEIGHT: 195.30124
SMILES: C1CCN(CC1)CC2CCCCC2=O
Structure:
CAS RN: 6966-09-2
CAS Name: 2-(1-piperidinylmethyl)-1-cyclohexanone hydrochloride
OPENEYE Name: 2-(1-piperidylmethyl)cyclohexanone hydrochloride
IUPAC Name: 2-(piperidin-1-ylmethyl)cyclohexan-1-one hydrochloride
SYSTEMATIC NAME: 2-(piperidin-1-ylmethyl)cyclohexan-1-one hydrochloride
MOLECULAR FORMULA: C12H22ClNO
MOLECULAR WEIGHT: 231.76218
SMILES: C1CCN(CC1)CC2CCCCC2=O.Cl
Structure:
CAS RN: 6909-55-3
CAS Name: 4-[5-(4-chlorophenyl)-3,4-dihydropyrazol-2-yl]benzoic acid methyl ester
OPENEYE Name: methyl 4-[5-(4-chlorophenyl)-3,4-dihydropyrazol-2-yl]benzoate
IUPAC Name: methyl 4-[5-(4-chlorophenyl)-3,4-dihydropyrazol-2-yl]benzoate
SYSTEMATIC NAME: methyl 4-[5-(4-chlorophenyl)-3,4-dihydropyrazol-2-yl]benzoate
MOLECULAR FORMULA: C17H15ClN2O2
MOLECULAR WEIGHT: 314.7662
SMILES: COC(=O)C1=CC=C(C=C1)N2CCC(=N2)C3=CC=C(C=C3)Cl
Structure:
CAS RN: 6875-10-1
CAS Name: formic acid [3-[(3,5-dihydroxy-4-methoxy-6-methyl-2-oxanyl)oxy]-14-hydroxy-10,13-dimethyl-17-(5-oxo-2H-furan-3-yl)-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-16-yl] ester
OPENEYE Name: [3-(3,5-dihydroxy-4-methoxy-6-methyl-tetrahydropyran-2-yl)oxy-14-hydroxy-10,13-dimethyl-17-(5-oxo-2H-furan-3-yl)-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-16-yl] formate
IUPAC Name: [3-(3,5-dihydroxy-4-methoxy-6-methyloxan-2-yl)oxy-14-hydroxy-10,13-dimethyl-17-(5-oxo-2H-furan-3-yl)-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-16-yl] formate
SYSTEMATIC NAME: [3-[4-methoxy-6-methyl-3,5-bis(oxidanyl)oxan-2-yl]oxy-10,13-dimethyl-14-oxidanyl-17-(5-oxidanylidene-2H-furan-3-yl)-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-16-yl] methanoate
MOLECULAR FORMULA: C31H46O10
MOLECULAR WEIGHT: 578.69094
SMILES: CC1C(C(C(C(O1)OC2CCC3(C(C2)CCC4C3CCC5(C4(CC(C5C6=CC(=O)OC6)OC=O)O)C)C)O)OC)O
Structure:
CAS RN: 6801-29-2
CAS Name: (3R,5S,8R,9S,10S,13S,14S,17S)-17-[(1S)-1-(dimethylamino)ethyl]-N,10,13-trimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-amine
OPENEYE Name: (3R,5S,8R,9S,10S,13S,14S,17S)-17-[(1S)-1-(dimethylamino)ethyl]-N,10,13-trimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-amine
IUPAC Name: (3R,5S,8R,9S,10S,13S,14S,17S)-17-[(1S)-1-(dimethylamino)ethyl]-N,10,13-trimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-amine
SYSTEMATIC NAME: (3R,5S,8R,9S,10S,13S,14S,17S)-17-[(1S)-1-(dimethylamino)ethyl]-N,10,13-trimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-amine
MOLECULAR FORMULA: C24H44N2
MOLECULAR WEIGHT: 360.61956
SMILES: C[C@@H]([C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC[C@@H]4[C@@]3(CC[C@H](C4)NC)C)C)N(C)C
Structure:
CAS RN: 4174-74-7
CAS Name: 3-[2-[(3-amino-5-ethyl-6-phenyl-8-phenanthridin-5-iumyl)imino]hydrazinyl]benzenecarboximidamide chloride hydrochloride
OPENEYE Name: 3-[2-(3-amino-5-ethyl-6-phenyl-phenanthridin-5-ium-8-yl)iminohydrazino]benzamidine chloride hydrochloride
IUPAC Name: 3-[2-(3-amino-5-ethyl-6-phenylphenanthridin-5-ium-8-yl)iminohydrazinyl]benzenecarboximidamide chloride hydrochloride
SYSTEMATIC NAME: 3-[2-(3-azanyl-5-ethyl-6-phenyl-phenanthridin-5-ium-8-yl)iminohydrazinyl]benzenecarboximidamide chloride hydrochloride
MOLECULAR FORMULA: C28H27Cl2N7
MOLECULAR WEIGHT: 532.46688
SMILES: CC[N+]1=C2C=C(C=CC2=C3C=CC(=CC3=C1C4=CC=CC=C4)N=NNC5=CC=CC(=C5)C(=N)N)N.Cl.[Cl-]
Structure:
CAS RN: 6700-42-1
CAS Name: tetrasodium (2-methyl-4-phosphonatooxy-1-naphthalenyl) phosphate hexahydrate
OPENEYE Name: tetrasodium (2-methyl-4-phosphonatooxy-1-naphthyl) phosphate hexahydrate
IUPAC Name: tetrasodium (2-methyl-4-phosphonatooxynaphthalen-1-yl) phosphate hexahydrate
SYSTEMATIC NAME: tetrasodium (2-methyl-4-phosphonatooxy-naphthalen-1-yl) phosphate hexahydrate
MOLECULAR FORMULA: C11H20Na4O14P2
MOLECULAR WEIGHT: 530.174702
SMILES: CC1=C(C2=CC=CC=C2C(=C1)OP(=O)([O-])[O-])OP(=O)([O-])[O-].O.O.O.O.O.O.[Na+].[Na+].[Na+].[Na+]
Structure:
CAS RN: 6696-47-5
CAS Name: (3R,5S,6S,7R,8S,9R,12R,13R,14S,15R)-6-[[(2S,3R,4S,6R)-4-(dimethylamino)-3-hydroxy-6-methyl-2-oxanyl]oxy]-14-hydroxy-8-[[(2R,4S,5S,6S)-5-hydroxy-4-methoxy-6-methyl-2-oxanyl]oxy]-5,7,9,12,13,15-hexamethyl-2,11-dioxaspiro[2.13]hexadecane-10,16-dione hydrochl
OPENEYE Name: (3R,5S,6S,7R,8S,9R,12R,13R,14S,15R)-6-[(2S,3R,4S,6R)-4-(dimethylamino)-3-hydroxy-6-methyl-tetrahydropyran-2-yl]oxy-14-hydroxy-8-[(2R,4S,5S,6S)-5-hydroxy-4-methoxy-6-methyl-tetrahydropyran-2-yl]oxy-5,7,9,12,13,15-hexamethyl-2,11-dioxaspiro[2.13]hexadecane-
IUPAC Name: (3R,5S,6S,7R,8S,9R,12R,13R,14S,15R)-6-[(2S,3R,4S,6R)-4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy-14-hydroxy-8-[(2R,4S,5S,6S)-5-hydroxy-4-methoxy-6-methyloxan-2-yl]oxy-5,7,9,12,13,15-hexamethyl-2,11-dioxaspiro[2.13]hexadecane-10,16-dione hydrochlorid
SYSTEMATIC NAME: (3R,5S,6S,7R,8S,9R,12R,13R,14S,15R)-6-[(2S,3R,4S,6R)-4-(dimethylamino)-6-methyl-3-oxidanyl-oxan-2-yl]oxy-8-[(2R,4S,5S,6S)-4-methoxy-6-methyl-5-oxidanyl-oxan-2-yl]oxy-5,7,9,12,13,15-hexamethyl-14-oxidanyl-2,11-dioxaspiro[2.13]hexadecane-10,16-dione hydroch
MOLECULAR FORMULA: C35H62ClNO12
MOLECULAR WEIGHT: 724.31928
SMILES: C[C@@H]1C[C@@H]([C@H]([C@@H](O1)O[C@H]2[C@H](C[C@@]3(CO3)C(=O)[C@@H]([C@H]([C@H]([C@H](OC(=O)[C@@H]([C@H]([C@@H]2C)O[C@H]4C[C@@H]([C@H]([C@@H](O4)C)O)OC)C)C)C)O)C)C)O)N(C)C.Cl
Structure:
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