1-oxidanylidene-4-phenyl-2H-isoquinoline-3-carboxylic acid

Systemtic Name: 1-oxidanylidene-4-phenyl-2H-isoquinoline-3-carboxylic acid Openeye Name: 1-oxo-4-phenyl-2H-isoquinoline-3-carboxylic acid CAS Name: 1-oxo-4-phenyl-2H-isoquinoline-3-carboxylic acid IUPAC Name: 1-oxo-4-phenyl-2H-isoquinoline-3-carboxylic acid Traditional Name: 1-keto-4-phenyl-2H-isoquinoline-3-carboxylic acid Formula: C16H11NO3 MolecularWeight: 265.26344

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(NC(=O)C3=CC=CC=C32)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C2=C(NC(=O)C3=CC=CC=C32)C(=O)O

InChI

InChI=1S/C16H11NO3/c18-15-12-9-5-4-8-11(12)13(14(17-15)16(19)20)10-6-2-1-3-7-10/h1-9H,(H,17,18)(H,19,20)