(3S,4R)-3-(4-methoxyphenyl)-2-(4-methylphenyl)-1-oxidanylidene-3,4-dihydroisoquinoline-4-carboxylic acid

Systemtic Name: (3S,4R)-3-(4-methoxyphenyl)-2-(4-methylphenyl)-1-oxidanylidene-3,4-dihydroisoquinoline-4-carboxylic acid Openeye Name: (3S,4R)-3-(4-methoxyphenyl)-1-oxo-2-(p-tolyl)-3,4-dihydroisoquinoline-4-carboxylic acid CAS Name: (3S,4R)-3-(4-methoxyphenyl)-2-(4-methylphenyl)-1-oxo-3,4-dihydroisoquinoline-4-carboxylic acid IUPAC Name: (3S,4R)-3-(4-methoxyphenyl)-2-(4-methylphenyl)-1-oxo-3,4-dihydroisoquinoline-4-carboxylic acid Traditional Name: (3S,4R)-1-keto-3-(4-methoxyphenyl)-2-(p-tolyl)-3,4-dihydroisoquinoline-4-carboxylic acid Formula: C24H21NO4 MolecularWeight: 387.42784

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(C(C3=CC=CC=C3C2=O)C(=O)O)C4=CC=C(C=C4)OC

Isomeric SMILES

CC1=CC=C(C=C1)N2[C@@H]([C@@H](C3=CC=CC=C3C2=O)C(=O)O)C4=CC=C(C=C4)OC

InChI

InChI=1S/C24H21NO4/c1-15-7-11-17(12-8-15)25-22(16-9-13-18(29-2)14-10-16)21(24(27)28)19-5-3-4-6-20(19)23(25)26/h3-14,21-22H,1-2H3,(H,27,28)/t21-,22-/m1/s1