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

Systemtic Name: methyl 2-[2-[(3-nitrophenyl)carbonylamino]-1,3-thiazol-4-yl]ethanoate Openeye Name: methyl 2-[2-[(3-nitrobenzoyl)amino]thiazol-4-yl]acetate CAS Name: 2-[2-[[(3-nitrophenyl)-oxomethyl]amino]-4-thiazolyl]acetic acid methyl ester IUPAC Name: methyl 2-[2-[(3-nitrobenzoyl)amino]-1,3-thiazol-4-yl]acetate Traditional Name: 2-[2-[(3-nitrobenzoyl)amino]thiazol-4-yl]acetic acid methyl ester Formula: C13H11N3O5S MolecularWeight: 321.30854

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1=CSC(=N1)NC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

COC(=O)CC1=CSC(=N1)NC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C13H11N3O5S/c1-21-11(17)6-9-7-22-13(14-9)15-12(18)8-3-2-4-10(5-8)16(19)20/h2-5,7H,6H2,1H3,(H,14,15,18)