ethyl 3-methyl-5-[(6-nitro-2-oxidanylidene-chromen-3-yl)carbonylamino]-1,2-thiazole-4-carboxylate

Systemtic Name: ethyl 3-methyl-5-[(6-nitro-2-oxidanylidene-chromen-3-yl)carbonylamino]-1,2-thiazole-4-carboxylate Openeye Name: ethyl 3-methyl-5-[(6-nitro-2-oxo-chromene-3-carbonyl)amino]isothiazole-4-carboxylate CAS Name: 3-methyl-5-[[(6-nitro-2-oxo-1-benzopyran-3-yl)-oxomethyl]amino]-4-isothiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 3-methyl-5-[(6-nitro-2-oxochromene-3-carbonyl)amino]-1,2-thiazole-4-carboxylate Traditional Name: 5-[(2-keto-6-nitro-chromene-3-carbonyl)amino]-3-methyl-isothiazole-4-carboxylic acid ethyl ester Formula: C17H13N3O7S MolecularWeight: 403.36602

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SN=C1C)NC(=O)C2=CC3=C(C=CC(=C3)[N+](=O)[O-])OC2=O

Isomeric SMILES

CCOC(=O)C1=C(SN=C1C)NC(=O)C2=CC3=C(C=CC(=C3)[N+](=O)[O-])OC2=O

InChI

InChI=1S/C17H13N3O7S/c1-3-26-17(23)13-8(2)19-28-15(13)18-14(21)11-7-9-6-10(20(24)25)4-5-12(9)27-16(11)22/h4-7H,3H2,1-2H3,(H,18,21)