methyl 3-[(6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl)carbonylamino]benzoate

Systemtic Name: methyl 3-[(6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl)carbonylamino]benzoate Openeye Name: methyl 3-[(6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinoline-2-carbonyl)amino]benzoate CAS Name: 3-[[(6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl)-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 3-[(6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinoline-2-carbonyl)amino]benzoate Traditional Name: 3-[(6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinoline-2-carbonyl)amino]benzoic acid methyl ester Formula: C26H26N2O5 MolecularWeight: 446.49504

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(N(CCC2=C1)C(=O)NC3=CC=CC(=C3)C(=O)OC)C4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C=C2C(N(CCC2=C1)C(=O)NC3=CC=CC(=C3)C(=O)OC)C4=CC=CC=C4)OC

InChI

InChI=1S/C26H26N2O5/c1-31-22-15-18-12-13-28(26(30)27-20-11-7-10-19(14-20)25(29)33-3)24(17-8-5-4-6-9-17)21(18)16-23(22)32-2/h4-11,14-16,24H,12-13H2,1-3H3,(H,27,30)