6-[3-chloranyl-4-(4-methylpiperazin-1-yl)phenyl]-2-oxidanylidene-1H-pyridine-3-carboxylic acid

Systemtic Name: 6-[3-chloranyl-4-(4-methylpiperazin-1-yl)phenyl]-2-oxidanylidene-1H-pyridine-3-carboxylic acid Openeye Name: 6-[3-chloro-4-(4-methylpiperazin-1-yl)phenyl]-2-oxo-1H-pyridine-3-carboxylic acid CAS Name: 6-[3-chloro-4-(4-methyl-1-piperazinyl)phenyl]-2-oxo-1H-pyridine-3-carboxylic acid IUPAC Name: 6-[3-chloro-4-(4-methylpiperazin-1-yl)phenyl]-2-oxo-1H-pyridine-3-carboxylic acid Traditional Name: 6-[3-chloro-4-(4-methylpiperazino)phenyl]-2-keto-1H-pyridine-3-carboxylic acid Formula: C17H18ClN3O3 MolecularWeight: 347.79612

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=C(C=C(C=C2)C3=CC=C(C(=O)N3)C(=O)O)Cl

Isomeric SMILES

CN1CCN(CC1)C2=C(C=C(C=C2)C3=CC=C(C(=O)N3)C(=O)O)Cl

InChI

InChI=1S/C17H18ClN3O3/c1-20-6-8-21(9-7-20)15-5-2-11(10-13(15)18)14-4-3-12(17(23)24)16(22)19-14/h2-5,10H,6-9H2,1H3,(H,19,22)(H,23,24)