ethyl 3-methyl-5-[(5-nitro-2-oxidanylidene-indol-3-yl)amino]thiophene-2-carboxylate

Systemtic Name: ethyl 3-methyl-5-[(5-nitro-2-oxidanylidene-indol-3-yl)amino]thiophene-2-carboxylate Openeye Name: ethyl 3-methyl-5-[(5-nitro-2-oxo-indol-3-yl)amino]thiophene-2-carboxylate CAS Name: 3-methyl-5-[(5-nitro-2-oxo-3-indolyl)amino]-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 3-methyl-5-[(5-nitro-2-oxoindol-3-yl)amino]thiophene-2-carboxylate Traditional Name: 5-[(2-keto-5-nitro-indol-3-yl)amino]-3-methyl-thiophene-2-carboxylic acid ethyl ester Formula: C16H13N3O5S MolecularWeight: 359.35652

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=C(S1)NC2=C3C=C(C=CC3=NC2=O)[N+](=O)[O-])C

Isomeric SMILES

CCOC(=O)C1=C(C=C(S1)NC2=C3C=C(C=CC3=NC2=O)[N+](=O)[O-])C

InChI

InChI=1S/C16H13N3O5S/c1-3-24-16(21)14-8(2)6-12(25-14)18-13-10-7-9(19(22)23)4-5-11(10)17-15(13)20/h4-7H,3H2,1-2H3,(H,17,18,20)