2-oxidanylidene-4-(4-thiophen-2-ylcarbonylpiperazin-1-yl)-1H-quinoline-3-carboxylic acid

Systemtic Name: 2-oxidanylidene-4-(4-thiophen-2-ylcarbonylpiperazin-1-yl)-1H-quinoline-3-carboxylic acid Openeye Name: 2-oxo-4-[4-(thiophene-2-carbonyl)piperazin-1-yl]-1H-quinoline-3-carboxylic acid CAS Name: 2-oxo-4-[4-[oxo(thiophen-2-yl)methyl]-1-piperazinyl]-1H-quinoline-3-carboxylic acid IUPAC Name: 2-oxo-4-[4-(thiophene-2-carbonyl)piperazin-1-yl]-1H-quinoline-3-carboxylic acid Traditional Name: 2-keto-4-[4-(2-thenoyl)piperazino]-1H-quinoline-3-carboxylic acid Formula: C19H17N3O4S MolecularWeight: 383.42098

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C(=O)NC3=CC=CC=C32)C(=O)O)C(=O)C4=CC=CS4

Isomeric SMILES

C1CN(CCN1C2=C(C(=O)NC3=CC=CC=C32)C(=O)O)C(=O)C4=CC=CS4

InChI

InChI=1S/C19H17N3O4S/c23-17-15(19(25)26)16(12-4-1-2-5-13(12)20-17)21-7-9-22(10-8-21)18(24)14-6-3-11-27-14/h1-6,11H,7-10H2,(H,20,23)(H,25,26)