(3R)-1,4-bis(oxidanylidene)-3-phenyl-2H-isoquinoline-3-carboxylic acid

Systemtic Name: (3R)-1,4-bis(oxidanylidene)-3-phenyl-2H-isoquinoline-3-carboxylic acid Openeye Name: (3R)-1,4-dioxo-3-phenyl-2H-isoquinoline-3-carboxylic acid CAS Name: (3R)-1,4-dioxo-3-phenyl-2H-isoquinoline-3-carboxylic acid IUPAC Name: (3R)-1,4-dioxo-3-phenyl-2H-isoquinoline-3-carboxylic acid Traditional Name: (3R)-1,4-diketo-3-phenyl-2H-isoquinoline-3-carboxylic acid Formula: C16H11NO4 MolecularWeight: 281.26284

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2(C(=O)C3=CC=CC=C3C(=O)N2)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)[C@@]2(C(=O)C3=CC=CC=C3C(=O)N2)C(=O)O

InChI

InChI=1S/C16H11NO4/c18-13-11-8-4-5-9-12(11)14(19)17-16(13,15(20)21)10-6-2-1-3-7-10/h1-9H,(H,17,19)(H,20,21)/t16-/m1/s1