3-oxidanylidene-4-phenyl-4H-isoquinoline-1-carboxylic acid

Systemtic Name: 3-oxidanylidene-4-phenyl-4H-isoquinoline-1-carboxylic acid Openeye Name: 3-oxo-4-phenyl-4H-isoquinoline-1-carboxylic acid CAS Name: 3-oxo-4-phenyl-4H-isoquinoline-1-carboxylic acid IUPAC Name: 3-oxo-4-phenyl-4H-isoquinoline-1-carboxylic acid Traditional Name: 3-keto-4-phenyl-4H-isoquinoline-1-carboxylic acid Formula: C16H11NO3 MolecularWeight: 265.26344

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2C3=CC=CC=C3C(=NC2=O)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C2C3=CC=CC=C3C(=NC2=O)C(=O)O

InChI

InChI=1S/C16H11NO3/c18-15-13(10-6-2-1-3-7-10)11-8-4-5-9-12(11)14(17-15)16(19)20/h1-9,13H,(H,19,20)