ethyl 3-(cyclohexylcarbonylamino)-5-(3-nitrophenyl)thiophene-2-carboxylate

Systemtic Name: ethyl 3-(cyclohexylcarbonylamino)-5-(3-nitrophenyl)thiophene-2-carboxylate Openeye Name: ethyl 3-(cyclohexanecarbonylamino)-5-(3-nitrophenyl)thiophene-2-carboxylate CAS Name: 3-[[cyclohexyl(oxo)methyl]amino]-5-(3-nitrophenyl)-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 3-(cyclohexanecarbonylamino)-5-(3-nitrophenyl)thiophene-2-carboxylate Traditional Name: 3-(cyclohexanecarbonylamino)-5-(3-nitrophenyl)thiophene-2-carboxylic acid ethyl ester Formula: C20H22N2O5S MolecularWeight: 402.46408

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=C(S1)C2=CC(=CC=C2)[N+](=O)[O-])NC(=O)C3CCCCC3

Isomeric SMILES

CCOC(=O)C1=C(C=C(S1)C2=CC(=CC=C2)[N+](=O)[O-])NC(=O)C3CCCCC3

InChI

InChI=1S/C20H22N2O5S/c1-2-27-20(24)18-16(21-19(23)13-7-4-3-5-8-13)12-17(28-18)14-9-6-10-15(11-14)22(25)26/h6,9-13H,2-5,7-8H2,1H3,(H,21,23)