2-(2,2-diphenylethanoyl)-6-oxidanyl-3,4-dihydro-1H-isoquinoline-3-carboxylic acid

Systemtic Name: 2-(2,2-diphenylethanoyl)-6-oxidanyl-3,4-dihydro-1H-isoquinoline-3-carboxylic acid Openeye Name: 2-(2,2-diphenylacetyl)-6-hydroxy-3,4-dihydro-1H-isoquinoline-3-carboxylic acid CAS Name: 6-hydroxy-2-(1-oxo-2,2-diphenylethyl)-3,4-dihydro-1H-isoquinoline-3-carboxylic acid IUPAC Name: 2-(2,2-diphenylacetyl)-6-hydroxy-3,4-dihydro-1H-isoquinoline-3-carboxylic acid Traditional Name: 2-(2,2-diphenylacetyl)-6-hydroxy-3,4-dihydro-1H-isoquinoline-3-carboxylic acid Formula: C24H21NO4 MolecularWeight: 387.42784

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(CC2=C1C=C(C=C2)O)C(=O)C(C3=CC=CC=C3)C4=CC=CC=C4)C(=O)O

Isomeric SMILES

C1C(N(CC2=C1C=C(C=C2)O)C(=O)C(C3=CC=CC=C3)C4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C24H21NO4/c26-20-12-11-18-15-25(21(24(28)29)14-19(18)13-20)23(27)22(16-7-3-1-4-8-16)17-9-5-2-6-10-17/h1-13,21-22,26H,14-15H2,(H,28,29)