3-[3,4-bis(phenylmethoxy)phenyl]-2-methyl-1-oxidanylidene-3,4-dihydroisoquinoline-4-carboxylic acid

Systemtic Name: 3-[3,4-bis(phenylmethoxy)phenyl]-2-methyl-1-oxidanylidene-3,4-dihydroisoquinoline-4-carboxylic acid Openeye Name: 3-(3,4-dibenzyloxyphenyl)-2-methyl-1-oxo-3,4-dihydroisoquinoline-4-carboxylic acid CAS Name: 3-[3,4-bis(phenylmethoxy)phenyl]-2-methyl-1-oxo-3,4-dihydroisoquinoline-4-carboxylic acid IUPAC Name: 3-[3,4-bis(phenylmethoxy)phenyl]-2-methyl-1-oxo-3,4-dihydroisoquinoline-4-carboxylic acid Traditional Name: 3-(3,4-dibenzoxyphenyl)-1-keto-2-methyl-3,4-dihydroisoquinoline-4-carboxylic acid Formula: C31H27NO5 MolecularWeight: 493.54978

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(C(C2=CC=CC=C2C1=O)C(=O)O)C3=CC(=C(C=C3)OCC4=CC=CC=C4)OCC5=CC=CC=C5

Isomeric SMILES

CN1C(C(C2=CC=CC=C2C1=O)C(=O)O)C3=CC(=C(C=C3)OCC4=CC=CC=C4)OCC5=CC=CC=C5

InChI

InChI=1S/C31H27NO5/c1-32-29(28(31(34)35)24-14-8-9-15-25(24)30(32)33)23-16-17-26(36-19-21-10-4-2-5-11-21)27(18-23)37-20-22-12-6-3-7-13-22/h2-18,28-29H,19-20H2,1H3,(H,34,35)