(5-ethanoyl-2-ethoxy-phenyl)methyl 1-thiophen-2-ylcarbonylpiperidine-4-carboxylate

Systemtic Name: (5-ethanoyl-2-ethoxy-phenyl)methyl 1-thiophen-2-ylcarbonylpiperidine-4-carboxylate Openeye Name: (5-acetyl-2-ethoxy-phenyl)methyl 1-(thiophene-2-carbonyl)piperidine-4-carboxylate CAS Name: 1-[oxo(thiophen-2-yl)methyl]-4-piperidinecarboxylic acid (5-acetyl-2-ethoxyphenyl)methyl ester IUPAC Name: (5-acetyl-2-ethoxyphenyl)methyl 1-(thiophene-2-carbonyl)piperidine-4-carboxylate Traditional Name: 1-(2-thenoyl)isonipecotic acid (5-acetyl-2-ethoxy-benzyl) ester Formula: C22H25NO5S MolecularWeight: 415.5026

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)C)COC(=O)C2CCN(CC2)C(=O)C3=CC=CS3

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)C)COC(=O)C2CCN(CC2)C(=O)C3=CC=CS3

InChI

InChI=1S/C22H25NO5S/c1-3-27-19-7-6-17(15(2)24)13-18(19)14-28-22(26)16-8-10-23(11-9-16)21(25)20-5-4-12-29-20/h4-7,12-13,16H,3,8-11,14H2,1-2H3