methyl 4-[(2-ethoxycarbonylphenyl)amino]-1-(1-thiophen-2-ylethyl)piperidine-4-carboxylate

Systemtic Name: methyl 4-[(2-ethoxycarbonylphenyl)amino]-1-(1-thiophen-2-ylethyl)piperidine-4-carboxylate Openeye Name: methyl 4-(2-ethoxycarbonylanilino)-1-[1-(2-thienyl)ethyl]piperidine-4-carboxylate CAS Name: 4-(2-ethoxycarbonylanilino)-1-(1-thiophen-2-ylethyl)-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 4-(2-ethoxycarbonylanilino)-1-(1-thiophen-2-ylethyl)piperidine-4-carboxylate Traditional Name: 4-(2-carbethoxyanilino)-1-[1-(2-thienyl)ethyl]isonipecotic acid methyl ester Formula: C22H28N2O4S MolecularWeight: 416.53372

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=CC=C1NC2(CCN(CC2)C(C)C3=CC=CS3)C(=O)OC

Isomeric SMILES

CCOC(=O)C1=CC=CC=C1NC2(CCN(CC2)C(C)C3=CC=CS3)C(=O)OC

InChI

InChI=1S/C22H28N2O4S/c1-4-28-20(25)17-8-5-6-9-18(17)23-22(21(26)27-3)11-13-24(14-12-22)16(2)19-10-7-15-29-19/h5-10,15-16,23H,4,11-14H2,1-3H3