[2-(3,3-diphenylpropylamino)-2-oxidanylidene-ethyl] 1-thiophen-2-ylcarbonylpiperidine-4-carboxylate

Systemtic Name: [2-(3,3-diphenylpropylamino)-2-oxidanylidene-ethyl] 1-thiophen-2-ylcarbonylpiperidine-4-carboxylate Openeye Name: [2-(3,3-diphenylpropylamino)-2-oxo-ethyl] 1-(thiophene-2-carbonyl)piperidine-4-carboxylate CAS Name: 1-[oxo(thiophen-2-yl)methyl]-4-piperidinecarboxylic acid [2-(3,3-diphenylpropylamino)-2-oxoethyl] ester IUPAC Name: [2-(3,3-diphenylpropylamino)-2-oxoethyl] 1-(thiophene-2-carbonyl)piperidine-4-carboxylate Traditional Name: 1-(2-thenoyl)isonipecotic acid [2-(3,3-diphenylpropylamino)-2-keto-ethyl] ester Formula: C28H30N2O4S MolecularWeight: 490.6138

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)OCC(=O)NCCC(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)C4=CC=CS4

Isomeric SMILES

C1CN(CCC1C(=O)OCC(=O)NCCC(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)C4=CC=CS4

InChI

InChI=1S/C28H30N2O4S/c31-26(29-16-13-24(21-8-3-1-4-9-21)22-10-5-2-6-11-22)20-34-28(33)23-14-17-30(18-15-23)27(32)25-12-7-19-35-25/h1-12,19,23-24H,13-18,20H2,(H,29,31)