[2-[(1-cyanocyclohexyl)amino]-2-oxidanylidene-ethyl] 2-[(4-chloranylpyridin-2-yl)carbonylamino]ethanoate

Systemtic Name: [2-[(1-cyanocyclohexyl)amino]-2-oxidanylidene-ethyl] 2-[(4-chloranylpyridin-2-yl)carbonylamino]ethanoate Openeye Name: [2-[(1-cyanocyclohexyl)amino]-2-oxo-ethyl] 2-[(4-chloropyridine-2-carbonyl)amino]acetate CAS Name: 2-[[(4-chloro-2-pyridinyl)-oxomethyl]amino]acetic acid [2-[(1-cyanocyclohexyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[(1-cyanocyclohexyl)amino]-2-oxoethyl] 2-[(4-chloropyridine-2-carbonyl)amino]acetate Traditional Name: 2-[(4-chloropicolinoyl)amino]acetic acid [2-[(1-cyanocyclohexyl)amino]-2-keto-ethyl] ester Formula: C17H19ClN4O4 MolecularWeight: 378.81016

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(C#N)NC(=O)COC(=O)CNC(=O)C2=NC=CC(=C2)Cl

Isomeric SMILES

C1CCC(CC1)(C#N)NC(=O)COC(=O)CNC(=O)C2=NC=CC(=C2)Cl

InChI

InChI=1S/C17H19ClN4O4/c18-12-4-7-20-13(8-12)16(25)21-9-15(24)26-10-14(23)22-17(11-19)5-2-1-3-6-17/h4,7-8H,1-3,5-6,9-10H2,(H,21,25)(H,22,23)