methyl 2-[2-[4-[(4-phenylphenyl)carbonylamino]butyl]-3,4-dihydro-1H-isoquinolin-7-yl]ethanoate

Systemtic Name: methyl 2-[2-[4-[(4-phenylphenyl)carbonylamino]butyl]-3,4-dihydro-1H-isoquinolin-7-yl]ethanoate Openeye Name: methyl 2-[2-[4-[(4-phenylbenzoyl)amino]butyl]-3,4-dihydro-1H-isoquinolin-7-yl]acetate CAS Name: 2-[2-[4-[[oxo-(4-phenylphenyl)methyl]amino]butyl]-3,4-dihydro-1H-isoquinolin-7-yl]acetic acid methyl ester IUPAC Name: methyl 2-[2-[4-[(4-phenylbenzoyl)amino]butyl]-3,4-dihydro-1H-isoquinolin-7-yl]acetate Traditional Name: 2-[2-[4-[(4-phenylbenzoyl)amino]butyl]-3,4-dihydro-1H-isoquinolin-7-yl]acetic acid methyl ester Formula: C29H32N2O3 MolecularWeight: 456.57598

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1=CC2=C(CCN(C2)CCCCNC(=O)C3=CC=C(C=C3)C4=CC=CC=C4)C=C1

Isomeric SMILES

COC(=O)CC1=CC2=C(CCN(C2)CCCCNC(=O)C3=CC=C(C=C3)C4=CC=CC=C4)C=C1

InChI

InChI=1S/C29H32N2O3/c1-34-28(32)20-22-9-10-25-15-18-31(21-27(25)19-22)17-6-5-16-30-29(33)26-13-11-24(12-14-26)23-7-3-2-4-8-23/h2-4,7-14,19H,5-6,15-18,20-21H2,1H3,(H,30,33)