ethyl 2-[2-[(2-methoxy-5-nitro-phenyl)amino]ethanoylamino]-5-propan-2-yl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[2-[(2-methoxy-5-nitro-phenyl)amino]ethanoylamino]-5-propan-2-yl-thiophene-3-carboxylate Openeye Name: ethyl 5-isopropyl-2-[[2-(2-methoxy-5-nitro-anilino)acetyl]amino]thiophene-3-carboxylate CAS Name: 2-[[2-(2-methoxy-5-nitroanilino)-1-oxoethyl]amino]-5-propan-2-yl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-(2-methoxy-5-nitroanilino)acetyl]amino]-5-propan-2-ylthiophene-3-carboxylate Traditional Name: 5-isopropyl-2-[[2-(2-methoxy-5-nitro-anilino)acetyl]amino]thiophene-3-carboxylic acid ethyl ester Formula: C19H23N3O6S MolecularWeight: 421.46742

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1)C(C)C)NC(=O)CNC2=C(C=CC(=C2)[N+](=O)[O-])OC

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1)C(C)C)NC(=O)CNC2=C(C=CC(=C2)[N+](=O)[O-])OC

InChI

InChI=1S/C19H23N3O6S/c1-5-28-19(24)13-9-16(11(2)3)29-18(13)21-17(23)10-20-14-8-12(22(25)26)6-7-15(14)27-4/h6-9,11,20H,5,10H2,1-4H3,(H,21,23)