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

Systemtic Name: methyl 4-[ethanoyl(phenylmethoxy)amino]-1-(2-thiophen-2-ylethyl)piperidine-4-carboxylate Openeye Name: methyl 4-[acetyl(benzyloxy)amino]-1-[2-(2-thienyl)ethyl]piperidine-4-carboxylate CAS Name: 4-[acetyl(phenylmethoxy)amino]-1-(2-thiophen-2-ylethyl)-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 4-[acetyl(phenylmethoxy)amino]-1-(2-thiophen-2-ylethyl)piperidine-4-carboxylate Traditional Name: 4-[acetyl(benzoxy)amino]-1-[2-(2-thienyl)ethyl]isonipecotic acid methyl ester Formula: C22H28N2O4S MolecularWeight: 416.53372

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N(C1(CCN(CC1)CCC2=CC=CS2)C(=O)OC)OCC3=CC=CC=C3

Isomeric SMILES

CC(=O)N(C1(CCN(CC1)CCC2=CC=CS2)C(=O)OC)OCC3=CC=CC=C3

InChI

InChI=1S/C22H28N2O4S/c1-18(25)24(28-17-19-7-4-3-5-8-19)22(21(26)27-2)11-14-23(15-12-22)13-10-20-9-6-16-29-20/h3-9,16H,10-15,17H2,1-2H3