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

Systemtic Name: [2-(azocan-1-yl)-2-oxidanylidene-ethyl] 2-[(4-chloranylpyridin-2-yl)carbonylamino]ethanoate Openeye Name: [2-(azocan-1-yl)-2-oxo-ethyl] 2-[(4-chloropyridine-2-carbonyl)amino]acetate CAS Name: 2-[[(4-chloro-2-pyridinyl)-oxomethyl]amino]acetic acid [2-(1-azocanyl)-2-oxoethyl] ester IUPAC Name: [2-(azocan-1-yl)-2-oxoethyl] 2-[(4-chloropyridine-2-carbonyl)amino]acetate Traditional Name: 2-[(4-chloropicolinoyl)amino]acetic acid [2-(azocan-1-yl)-2-keto-ethyl] ester Formula: C17H22ClN3O4 MolecularWeight: 367.82728

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CCC1)C(=O)COC(=O)CNC(=O)C2=NC=CC(=C2)Cl

Isomeric SMILES

C1CCCN(CCC1)C(=O)COC(=O)CNC(=O)C2=NC=CC(=C2)Cl

InChI

InChI=1S/C17H22ClN3O4/c18-13-6-7-19-14(10-13)17(24)20-11-16(23)25-12-15(22)21-8-4-2-1-3-5-9-21/h6-7,10H,1-5,8-9,11-12H2,(H,20,24)