ethyl 4-[[6,7-dimethoxy-2-(4-piperidin-1-ylsulfonylphenyl)carbonyl-3,4-dihydro-1H-isoquinolin-1-yl]methoxy]benzoate

Systemtic Name: ethyl 4-[[6,7-dimethoxy-2-(4-piperidin-1-ylsulfonylphenyl)carbonyl-3,4-dihydro-1H-isoquinolin-1-yl]methoxy]benzoate Openeye Name: ethyl 4-[[6,7-dimethoxy-2-[4-(1-piperidylsulfonyl)benzoyl]-3,4-dihydro-1H-isoquinolin-1-yl]methoxy]benzoate CAS Name: 4-[[6,7-dimethoxy-2-[oxo-[4-(1-piperidinylsulfonyl)phenyl]methyl]-3,4-dihydro-1H-isoquinolin-1-yl]methoxy]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[6,7-dimethoxy-2-(4-piperidin-1-ylsulfonylbenzoyl)-3,4-dihydro-1H-isoquinolin-1-yl]methoxy]benzoate Traditional Name: 4-[[6,7-dimethoxy-2-(4-piperidinosulfonylbenzoyl)-3,4-dihydro-1H-isoquinolin-1-yl]methoxy]benzoic acid ethyl ester Formula: C33H38N2O8S MolecularWeight: 622.72842

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)OCC2C3=CC(=C(C=C3CCN2C(=O)C4=CC=C(C=C4)S(=O)(=O)N5CCCCC5)OC)OC

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)OCC2C3=CC(=C(C=C3CCN2C(=O)C4=CC=C(C=C4)S(=O)(=O)N5CCCCC5)OC)OC

InChI

InChI=1S/C33H38N2O8S/c1-4-42-33(37)24-8-12-26(13-9-24)43-22-29-28-21-31(41-3)30(40-2)20-25(28)16-19-35(29)32(36)23-10-14-27(15-11-23)44(38,39)34-17-6-5-7-18-34/h8-15,20-21,29H,4-7,16-19,22H2,1-3H3