4-oxidanylidene-1-(phenylmethyl)quinoline-3-carboxylate

Systemtic Name: 4-oxidanylidene-1-(phenylmethyl)quinoline-3-carboxylate Openeye Name: 1-benzyl-4-oxo-quinoline-3-carboxylate CAS Name: 4-oxo-1-(phenylmethyl)-3-quinolinecarboxylate IUPAC Name: 1-benzyl-4-oxoquinoline-3-carboxylate Traditional Name: 1-benzyl-4-keto-quinoline-3-carboxylate Formula: C17H12NO3- MolecularWeight: 278.28208

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=C(C(=O)C3=CC=CC=C32)C(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CN2C=C(C(=O)C3=CC=CC=C32)C(=O)[O-]

InChI

InChI=1S/C17H13NO3/c19-16-13-8-4-5-9-15(13)18(11-14(16)17(20)21)10-12-6-2-1-3-7-12/h1-9,11H,10H2,(H,20,21)/p-1