4-[(6-chloranyl-2-oxidanylidene-1H-quinolin-4-yl)-(pyridin-4-ylmethyl)amino]piperidine-1-carboxylic acid

Systemtic Name: 4-[(6-chloranyl-2-oxidanylidene-1H-quinolin-4-yl)-(pyridin-4-ylmethyl)amino]piperidine-1-carboxylic acid Openeye Name: 4-[(6-chloro-2-oxo-1H-quinolin-4-yl)-(4-pyridylmethyl)amino]piperidine-1-carboxylic acid CAS Name: 4-[(6-chloro-2-oxo-1H-quinolin-4-yl)-(pyridin-4-ylmethyl)amino]-1-piperidinecarboxylic acid IUPAC Name: 4-[(6-chloro-2-oxo-1H-quinolin-4-yl)-(pyridin-4-ylmethyl)amino]piperidine-1-carboxylic acid Traditional Name: 4-[(6-chloro-2-keto-1H-quinolin-4-yl)-(4-pyridylmethyl)amino]piperidine-1-carboxylic acid Formula: C21H21ClN4O3 MolecularWeight: 412.86944

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N(CC2=CC=NC=C2)C3=CC(=O)NC4=C3C=C(C=C4)Cl)C(=O)O

Isomeric SMILES

C1CN(CCC1N(CC2=CC=NC=C2)C3=CC(=O)NC4=C3C=C(C=C4)Cl)C(=O)O

InChI

InChI=1S/C21H21ClN4O3/c22-15-1-2-18-17(11-15)19(12-20(27)24-18)26(13-14-3-7-23-8-4-14)16-5-9-25(10-6-16)21(28)29/h1-4,7-8,11-12,16H,5-6,9-10,13H2,(H,24,27)(H,28,29)