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

Systemtic Name: 2-oxidanylidene-6-[3-[4-(phenylmethyl)piperazin-1-yl]phenyl]-1H-pyridine-3-carboxylic acid Openeye Name: 6-[3-(4-benzylpiperazin-1-yl)phenyl]-2-oxo-1H-pyridine-3-carboxylic acid CAS Name: 2-oxo-6-[3-[4-(phenylmethyl)-1-piperazinyl]phenyl]-1H-pyridine-3-carboxylic acid IUPAC Name: 6-[3-(4-benzylpiperazin-1-yl)phenyl]-2-oxo-1H-pyridine-3-carboxylic acid Traditional Name: 6-[3-(4-benzylpiperazino)phenyl]-2-keto-1H-pyridine-3-carboxylic acid Formula: C23H23N3O3 MolecularWeight: 389.44702

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)C3=CC=CC(=C3)C4=CC=C(C(=O)N4)C(=O)O

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)C3=CC=CC(=C3)C4=CC=C(C(=O)N4)C(=O)O

InChI

InChI=1S/C23H23N3O3/c27-22-20(23(28)29)9-10-21(24-22)18-7-4-8-19(15-18)26-13-11-25(12-14-26)16-17-5-2-1-3-6-17/h1-10,15H,11-14,16H2,(H,24,27)(H,28,29)