6-[(Z)-N-(2-oxidanylidenepyrrolidin-1-yl)-C-(quinolin-4-ylmethyl)carbonimidoyl]pyridine-2-carboxylic acid

Systemtic Name: 6-[(Z)-N-(2-oxidanylidenepyrrolidin-1-yl)-C-(quinolin-4-ylmethyl)carbonimidoyl]pyridine-2-carboxylic acid Openeye Name: 6-[(Z)-N-(2-oxopyrrolidin-1-yl)-C-(4-quinolylmethyl)carbonimidoyl]pyridine-2-carboxylic acid CAS Name: 6-[(1Z)-1-[(2-oxo-1-pyrrolidinyl)imino]-2-(4-quinolinyl)ethyl]-2-pyridinecarboxylic acid IUPAC Name: 6-[(Z)-N-(2-oxopyrrolidin-1-yl)-C-(quinolin-4-ylmethyl)carbonimidoyl]pyridine-2-carboxylic acid Traditional Name: 6-[(Z)-N-(2-ketopyrrolidino)-C-(4-quinolylmethyl)carbonimidoyl]picolinic acid Formula: C21H18N4O3 MolecularWeight: 374.39262

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)N=C(CC2=CC=NC3=CC=CC=C23)C4=NC(=CC=C4)C(=O)O

Isomeric SMILES

C1CC(=O)N(C1)/N=C(/CC2=CC=NC3=CC=CC=C23)\C4=NC(=CC=C4)C(=O)O

InChI

InChI=1S/C21H18N4O3/c26-20-9-4-12-25(20)24-19(17-7-3-8-18(23-17)21(27)28)13-14-10-11-22-16-6-2-1-5-15(14)16/h1-3,5-8,10-11H,4,9,12-13H2,(H,27,28)/b24-19-