methyl 2-(3-phenoxyphenyl)carbonyl-3,4-dihydro-1H-isoquinoline-5-carboxylate

Systemtic Name: methyl 2-(3-phenoxyphenyl)carbonyl-3,4-dihydro-1H-isoquinoline-5-carboxylate Openeye Name: methyl 2-(3-phenoxybenzoyl)-3,4-dihydro-1H-isoquinoline-5-carboxylate CAS Name: 2-[oxo-(3-phenoxyphenyl)methyl]-3,4-dihydro-1H-isoquinoline-5-carboxylic acid methyl ester IUPAC Name: methyl 2-(3-phenoxybenzoyl)-3,4-dihydro-1H-isoquinoline-5-carboxylate Traditional Name: 2-(3-phenoxybenzoyl)-3,4-dihydro-1H-isoquinoline-5-carboxylic acid methyl ester Formula: C24H21NO4 MolecularWeight: 387.42784

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C2CCN(CC2=CC=C1)C(=O)C3=CC(=CC=C3)OC4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=C2CCN(CC2=CC=C1)C(=O)C3=CC(=CC=C3)OC4=CC=CC=C4

InChI

InChI=1S/C24H21NO4/c1-28-24(27)22-12-6-8-18-16-25(14-13-21(18)22)23(26)17-7-5-11-20(15-17)29-19-9-3-2-4-10-19/h2-12,15H,13-14,16H2,1H3