ethyl 4-[1-[[1-(3-methylphenyl)imidazol-2-yl]methyl]piperidin-3-yl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[1-[[1-(3-methylphenyl)imidazol-2-yl]methyl]piperidin-3-yl]piperazine-1-carboxylate Openeye Name: ethyl 4-[1-[[1-(m-tolyl)imidazol-2-yl]methyl]-3-piperidyl]piperazine-1-carboxylate CAS Name: 4-[1-[[1-(3-methylphenyl)-2-imidazolyl]methyl]-3-piperidinyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[1-[[1-(3-methylphenyl)imidazol-2-yl]methyl]piperidin-3-yl]piperazine-1-carboxylate Traditional Name: 4-[1-[[1-(m-tolyl)imidazol-2-yl]methyl]-3-piperidyl]piperazine-1-carboxylic acid ethyl ester Formula: C23H33N5O2 MolecularWeight: 411.54042

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C2CCCN(C2)CC3=NC=CN3C4=CC=CC(=C4)C

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C2CCCN(C2)CC3=NC=CN3C4=CC=CC(=C4)C

InChI

InChI=1S/C23H33N5O2/c1-3-30-23(29)27-14-12-26(13-15-27)21-8-5-10-25(17-21)18-22-24-9-11-28(22)20-7-4-6-19(2)16-20/h4,6-7,9,11,16,21H,3,5,8,10,12-15,17-18H2,1-2H3