ethyl 4-methyl-2-[(3-nitrophenyl)carbonylamino]-5-piperidin-1-ylcarbonyl-thiophene-3-carboxylate

Systemtic Name: ethyl 4-methyl-2-[(3-nitrophenyl)carbonylamino]-5-piperidin-1-ylcarbonyl-thiophene-3-carboxylate Openeye Name: ethyl 4-methyl-2-[(3-nitrobenzoyl)amino]-5-(piperidine-1-carbonyl)thiophene-3-carboxylate CAS Name: 4-methyl-2-[[(3-nitrophenyl)-oxomethyl]amino]-5-[oxo(1-piperidinyl)methyl]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-methyl-2-[(3-nitrobenzoyl)amino]-5-(piperidine-1-carbonyl)thiophene-3-carboxylate Traditional Name: 4-methyl-2-[(3-nitrobenzoyl)amino]-5-(piperidine-1-carbonyl)thiophene-3-carboxylic acid ethyl ester Formula: C21H23N3O6S MolecularWeight: 445.48882

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)N2CCCCC2)NC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)N2CCCCC2)NC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H23N3O6S/c1-3-30-21(27)16-13(2)17(20(26)23-10-5-4-6-11-23)31-19(16)22-18(25)14-8-7-9-15(12-14)24(28)29/h7-9,12H,3-6,10-11H2,1-2H3,(H,22,25)