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

Systemtic Name: [2-[(4-butylphenyl)amino]-2-oxidanylidene-ethyl] 2-[(4-chloranylpyridin-2-yl)carbonylamino]ethanoate Openeye Name: [2-(4-butylanilino)-2-oxo-ethyl] 2-[(4-chloropyridine-2-carbonyl)amino]acetate CAS Name: 2-[[(4-chloro-2-pyridinyl)-oxomethyl]amino]acetic acid [2-(4-butylanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-butylanilino)-2-oxoethyl] 2-[(4-chloropyridine-2-carbonyl)amino]acetate Traditional Name: 2-[(4-chloropicolinoyl)amino]acetic acid [2-(4-butylanilino)-2-keto-ethyl] ester Formula: C20H22ClN3O4 MolecularWeight: 403.85938

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=O)COC(=O)CNC(=O)C2=NC=CC(=C2)Cl

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=O)COC(=O)CNC(=O)C2=NC=CC(=C2)Cl

InChI

InChI=1S/C20H22ClN3O4/c1-2-3-4-14-5-7-16(8-6-14)24-18(25)13-28-19(26)12-23-20(27)17-11-15(21)9-10-22-17/h5-11H,2-4,12-13H2,1H3,(H,23,27)(H,24,25)