ethyl 1-[4-chloranyl-3-(thiophen-2-ylcarbonylamino)phenyl]carbonylpiperidine-4-carboxylate

Systemtic Name: ethyl 1-[4-chloranyl-3-(thiophen-2-ylcarbonylamino)phenyl]carbonylpiperidine-4-carboxylate Openeye Name: ethyl 1-[4-chloro-3-(thiophene-2-carbonylamino)benzoyl]piperidine-4-carboxylate CAS Name: 1-[[4-chloro-3-[[oxo(thiophen-2-yl)methyl]amino]phenyl]-oxomethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[4-chloro-3-(thiophene-2-carbonylamino)benzoyl]piperidine-4-carboxylate Traditional Name: 1-[4-chloro-3-(2-thenoylamino)benzoyl]isonipecotic acid ethyl ester Formula: C20H21ClN2O4S MolecularWeight: 420.90974

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)C2=CC(=C(C=C2)Cl)NC(=O)C3=CC=CS3

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)C2=CC(=C(C=C2)Cl)NC(=O)C3=CC=CS3

InChI

InChI=1S/C20H21ClN2O4S/c1-2-27-20(26)13-7-9-23(10-8-13)19(25)14-5-6-15(21)16(12-14)22-18(24)17-4-3-11-28-17/h3-6,11-13H,2,7-10H2,1H3,(H,22,24)