7-chloranyl-1-cyclopropyl-4-oxidanylidene-6-piperazin-1-yl-quinoline-3-carboxylic acid

Systemtic Name: 7-chloranyl-1-cyclopropyl-4-oxidanylidene-6-piperazin-1-yl-quinoline-3-carboxylic acid Openeye Name: 7-chloro-1-cyclopropyl-4-oxo-6-piperazin-1-yl-quinoline-3-carboxylic acid CAS Name: 7-chloro-1-cyclopropyl-4-oxo-6-(1-piperazinyl)-3-quinolinecarboxylic acid IUPAC Name: 7-chloro-1-cyclopropyl-4-oxo-6-piperazin-1-ylquinoline-3-carboxylic acid Traditional Name: 7-chloro-1-cyclopropyl-4-keto-6-piperazino-quinoline-3-carboxylic acid Formula: C17H18ClN3O3 MolecularWeight: 347.79612

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C=C(C(=O)C3=CC(=C(C=C32)Cl)N4CCNCC4)C(=O)O

Isomeric SMILES

C1CC1N2C=C(C(=O)C3=CC(=C(C=C32)Cl)N4CCNCC4)C(=O)O

InChI

InChI=1S/C17H18ClN3O3/c18-13-8-14-11(7-15(13)20-5-3-19-4-6-20)16(22)12(17(23)24)9-21(14)10-1-2-10/h7-10,19H,1-6H2,(H,23,24)