O1-methyl O3-[2-[(4-methyl-1,3-thiazol-2-yl)amino]-2-oxidanylidene-ethyl] 5-nitrobenzene-1,3-dicarboxylate

Systemtic Name: O1-methyl O3-[2-[(4-methyl-1,3-thiazol-2-yl)amino]-2-oxidanylidene-ethyl] 5-nitrobenzene-1,3-dicarboxylate Openeye Name: O1-methyl O3-[2-[(4-methylthiazol-2-yl)amino]-2-oxo-ethyl] 5-nitrobenzene-1,3-dicarboxylate CAS Name: 5-nitrobenzene-1,3-dicarboxylic acid O1-methyl ester O3-[2-[(4-methyl-2-thiazolyl)amino]-2-oxoethyl] ester IUPAC Name: 1-O-methyl 3-O-[2-[(4-methyl-1,3-thiazol-2-yl)amino]-2-oxoethyl] 5-nitrobenzene-1,3-dicarboxylate Traditional Name: 5-nitrobenzene-1,3-dicarboxylic acid O3-[2-keto-2-[(4-methylthiazol-2-yl)amino]ethyl] ester O1-methyl ester Formula: C15H13N3O7S MolecularWeight: 379.34462

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H13N3O7S/c1-8-7-26-15(16-8)17-12(19)6-25-14(21)10-3-9(13(20)24-2)4-11(5-10)18(22)23/h3-5,7H,6H2,1-2H3,(H,16,17,19)