ethyl 3-[(3-methoxyphenyl)methyl]-1-(3-methylthiophen-2-yl)carbonyl-piperidine-3-carboxylate

Systemtic Name: ethyl 3-[(3-methoxyphenyl)methyl]-1-(3-methylthiophen-2-yl)carbonyl-piperidine-3-carboxylate Openeye Name: ethyl 3-[(3-methoxyphenyl)methyl]-1-(3-methylthiophene-2-carbonyl)piperidine-3-carboxylate CAS Name: 3-[(3-methoxyphenyl)methyl]-1-[(3-methyl-2-thiophenyl)-oxomethyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[(3-methoxyphenyl)methyl]-1-(3-methylthiophene-2-carbonyl)piperidine-3-carboxylate Traditional Name: 3-m-anisyl-1-(3-methylthiophene-2-carbonyl)nipecotic acid ethyl ester Formula: C22H27NO4S MolecularWeight: 401.51908

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCCN(C1)C(=O)C2=C(C=CS2)C)CC3=CC(=CC=C3)OC

Isomeric SMILES

CCOC(=O)C1(CCCN(C1)C(=O)C2=C(C=CS2)C)CC3=CC(=CC=C3)OC

InChI

InChI=1S/C22H27NO4S/c1-4-27-21(25)22(14-17-7-5-8-18(13-17)26-3)10-6-11-23(15-22)20(24)19-16(2)9-12-28-19/h5,7-9,12-13H,4,6,10-11,14-15H2,1-3H3