[2-(4-methylphenyl)-1,3-thiazol-4-yl]methyl 2-[(3-nitrophenyl)carbonylamino]ethanoate

Systemtic Name: [2-(4-methylphenyl)-1,3-thiazol-4-yl]methyl 2-[(3-nitrophenyl)carbonylamino]ethanoate Openeye Name: [2-(p-tolyl)thiazol-4-yl]methyl 2-[(3-nitrobenzoyl)amino]acetate CAS Name: 2-[[(3-nitrophenyl)-oxomethyl]amino]acetic acid [2-(4-methylphenyl)-4-thiazolyl]methyl ester IUPAC Name: [2-(4-methylphenyl)-1,3-thiazol-4-yl]methyl 2-[(3-nitrobenzoyl)amino]acetate Traditional Name: 2-[(3-nitrobenzoyl)amino]acetic acid [2-(p-tolyl)thiazol-4-yl]methyl ester Formula: C20H17N3O5S MolecularWeight: 411.43108

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=CS2)COC(=O)CNC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=CS2)COC(=O)CNC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H17N3O5S/c1-13-5-7-14(8-6-13)20-22-16(12-29-20)11-28-18(24)10-21-19(25)15-3-2-4-17(9-15)23(26)27/h2-9,12H,10-11H2,1H3,(H,21,25)