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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22ClN3O4/c1-20(2,3)13-4-6-15(7-5-13)24-17(25)12-28-18(26)11-23-19(27)16-10-14(21)8-9-22-16/h4-10H,11-12H2,1-3H3,(H,23,27)(H,24,25)