[2-[(2S)-2-methylpiperidin-1-yl]-2-oxidanylidene-ethyl] 2,5-dimethyl-1-(4-methylphenyl)pyrrole-3-carboxylate

Systemtic Name: [2-[(2S)-2-methylpiperidin-1-yl]-2-oxidanylidene-ethyl] 2,5-dimethyl-1-(4-methylphenyl)pyrrole-3-carboxylate Openeye Name: [2-[(2S)-2-methyl-1-piperidyl]-2-oxo-ethyl] 2,5-dimethyl-1-(p-tolyl)pyrrole-3-carboxylate CAS Name: 2,5-dimethyl-1-(4-methylphenyl)-3-pyrrolecarboxylic acid [2-[(2S)-2-methyl-1-piperidinyl]-2-oxoethyl] ester IUPAC Name: [2-[(2S)-2-methylpiperidin-1-yl]-2-oxoethyl] 2,5-dimethyl-1-(4-methylphenyl)pyrrole-3-carboxylate Traditional Name: 2,5-dimethyl-1-(p-tolyl)pyrrole-3-carboxylic acid [2-keto-2-[(2S)-2-methylpiperidino]ethyl] ester Formula: C22H28N2O3 MolecularWeight: 368.46932

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1C(=O)COC(=O)C2=C(N(C(=C2)C)C3=CC=C(C=C3)C)C

Isomeric SMILES

C[C@H]1CCCCN1C(=O)COC(=O)C2=C(N(C(=C2)C)C3=CC=C(C=C3)C)C

InChI

InChI=1S/C22H28N2O3/c1-15-8-10-19(11-9-15)24-17(3)13-20(18(24)4)22(26)27-14-21(25)23-12-6-5-7-16(23)2/h8-11,13,16H,5-7,12,14H2,1-4H3/t16-/m0/s1