2-[methyl(phenyl)carbamoyl]-6-phenoxy-3,4-dihydro-1H-isoquinoline-3-carboxylic acid

Systemtic Name: 2-[methyl(phenyl)carbamoyl]-6-phenoxy-3,4-dihydro-1H-isoquinoline-3-carboxylic acid Openeye Name: 2-[methyl(phenyl)carbamoyl]-6-phenoxy-3,4-dihydro-1H-isoquinoline-3-carboxylic acid CAS Name: 2-[(N-methylanilino)-oxomethyl]-6-phenoxy-3,4-dihydro-1H-isoquinoline-3-carboxylic acid IUPAC Name: 2-[methyl(phenyl)carbamoyl]-6-phenoxy-3,4-dihydro-1H-isoquinoline-3-carboxylic acid Traditional Name: 2-[methyl(phenyl)carbamoyl]-6-phenoxy-3,4-dihydro-1H-isoquinoline-3-carboxylic acid Formula: C24H22N2O4 MolecularWeight: 402.44248

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=CC=C1)C(=O)N2CC3=C(CC2C(=O)O)C=C(C=C3)OC4=CC=CC=C4

Isomeric SMILES

CN(C1=CC=CC=C1)C(=O)N2CC3=C(CC2C(=O)O)C=C(C=C3)OC4=CC=CC=C4

InChI

InChI=1S/C24H22N2O4/c1-25(19-8-4-2-5-9-19)24(29)26-16-17-12-13-21(30-20-10-6-3-7-11-20)14-18(17)15-22(26)23(27)28/h2-14,22H,15-16H2,1H3,(H,27,28)