methyl 1-[2-[2,5-dimethyl-1-(thiophen-2-ylmethyl)pyrrol-3-yl]carbonyloxyethanoyl]piperidine-4-carboxylate

Systemtic Name: methyl 1-[2-[2,5-dimethyl-1-(thiophen-2-ylmethyl)pyrrol-3-yl]carbonyloxyethanoyl]piperidine-4-carboxylate Openeye Name: methyl 1-[2-[2,5-dimethyl-1-(2-thienylmethyl)pyrrole-3-carbonyl]oxyacetyl]piperidine-4-carboxylate CAS Name: 1-[2-[[2,5-dimethyl-1-(thiophen-2-ylmethyl)-3-pyrrolyl]-oxomethoxy]-1-oxoethyl]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[2-[2,5-dimethyl-1-(thiophen-2-ylmethyl)pyrrole-3-carbonyl]oxyacetyl]piperidine-4-carboxylate Traditional Name: 1-[2-[2,5-dimethyl-1-(2-thenyl)pyrrole-3-carbonyl]oxyacetyl]isonipecotic acid methyl ester Formula: C21H26N2O5S MolecularWeight: 418.50654

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CC2=CC=CS2)C)C(=O)OCC(=O)N3CCC(CC3)C(=O)OC

Isomeric SMILES

CC1=CC(=C(N1CC2=CC=CS2)C)C(=O)OCC(=O)N3CCC(CC3)C(=O)OC

InChI

InChI=1S/C21H26N2O5S/c1-14-11-18(15(2)23(14)12-17-5-4-10-29-17)21(26)28-13-19(24)22-8-6-16(7-9-22)20(25)27-3/h4-5,10-11,16H,6-9,12-13H2,1-3H3