ethyl 2-[2-(4-azanyl-3-nitro-phenyl)carbonyloxyethanoylamino]-4-ethyl-5-methyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[2-(4-azanyl-3-nitro-phenyl)carbonyloxyethanoylamino]-4-ethyl-5-methyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-(4-amino-3-nitro-benzoyl)oxyacetyl]amino]-4-ethyl-5-methyl-thiophene-3-carboxylate CAS Name: 2-[[2-[(4-amino-3-nitrophenyl)-oxomethoxy]-1-oxoethyl]amino]-4-ethyl-5-methyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-(4-amino-3-nitrobenzoyl)oxyacetyl]amino]-4-ethyl-5-methylthiophene-3-carboxylate Traditional Name: 2-[[2-(4-amino-3-nitro-benzoyl)oxyacetyl]amino]-4-ethyl-5-methyl-thiophene-3-carboxylic acid ethyl ester Formula: C19H21N3O7S MolecularWeight: 435.45094

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC(=C1C(=O)OCC)NC(=O)COC(=O)C2=CC(=C(C=C2)N)[N+](=O)[O-])C

Isomeric SMILES

CCC1=C(SC(=C1C(=O)OCC)NC(=O)COC(=O)C2=CC(=C(C=C2)N)[N+](=O)[O-])C

InChI

InChI=1S/C19H21N3O7S/c1-4-12-10(3)30-17(16(12)19(25)28-5-2)21-15(23)9-29-18(24)11-6-7-13(20)14(8-11)22(26)27/h6-8H,4-5,9,20H2,1-3H3,(H,21,23)