4-oxidanylidene-1-phenylsulfanyl-quinolizine-3-carboxylic acid

Systemtic Name: 4-oxidanylidene-1-phenylsulfanyl-quinolizine-3-carboxylic acid Openeye Name: 4-oxo-1-phenylsulfanyl-quinolizine-3-carboxylic acid CAS Name: 4-oxo-1-(phenylthio)-3-quinolizinecarboxylic acid IUPAC Name: 4-oxo-1-phenylsulfanylquinolizine-3-carboxylic acid Traditional Name: 4-keto-1-(phenylthio)quinolizine-3-carboxylic acid Formula: C16H11NO3S MolecularWeight: 297.32844

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SC2=C3C=CC=CN3C(=O)C(=C2)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)SC2=C3C=CC=CN3C(=O)C(=C2)C(=O)O

InChI

InChI=1S/C16H11NO3S/c18-15-12(16(19)20)10-14(13-8-4-5-9-17(13)15)21-11-6-2-1-3-7-11/h1-10H,(H,19,20)