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

Systemtic Name: (2-acetamido-1,3-thiazol-4-yl)methyl 2-[(3-nitrophenyl)carbonylamino]ethanoate Openeye Name: (2-acetamidothiazol-4-yl)methyl 2-[(3-nitrobenzoyl)amino]acetate CAS Name: 2-[[(3-nitrophenyl)-oxomethyl]amino]acetic acid (2-acetamido-4-thiazolyl)methyl ester IUPAC Name: (2-acetamido-1,3-thiazol-4-yl)methyl 2-[(3-nitrobenzoyl)amino]acetate Traditional Name: 2-[(3-nitrobenzoyl)amino]acetic acid (2-acetamidothiazol-4-yl)methyl ester Formula: C15H14N4O6S MolecularWeight: 378.35986

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=NC(=CS1)COC(=O)CNC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CC(=O)NC1=NC(=CS1)COC(=O)CNC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C15H14N4O6S/c1-9(20)17-15-18-11(8-26-15)7-25-13(21)6-16-14(22)10-3-2-4-12(5-10)19(23)24/h2-5,8H,6-7H2,1H3,(H,16,22)(H,17,18,20)