ethyl 4-[(3S)-3-(hydroxymethyl)-3-[(2-methylphenyl)methyl]piperidin-1-yl]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[(3S)-3-(hydroxymethyl)-3-[(2-methylphenyl)methyl]piperidin-1-yl]piperidine-1-carboxylate Openeye Name: ethyl 4-[(3S)-3-(hydroxymethyl)-3-(o-tolylmethyl)-1-piperidyl]piperidine-1-carboxylate CAS Name: 4-[(3S)-3-(hydroxymethyl)-3-[(2-methylphenyl)methyl]-1-piperidinyl]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(3S)-3-(hydroxymethyl)-3-[(2-methylphenyl)methyl]piperidin-1-yl]piperidine-1-carboxylate Traditional Name: 4-[(3S)-3-(2-methylbenzyl)-3-methylol-piperidino]piperidine-1-carboxylic acid ethyl ester Formula: C22H34N2O3 MolecularWeight: 374.51696

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)N2CCCC(C2)(CC3=CC=CC=C3C)CO

Isomeric SMILES

CCOC(=O)N1CCC(CC1)N2CCC[C@@](C2)(CC3=CC=CC=C3C)CO

InChI

InChI=1S/C22H34N2O3/c1-3-27-21(26)23-13-9-20(10-14-23)24-12-6-11-22(16-24,17-25)15-19-8-5-4-7-18(19)2/h4-5,7-8,20,25H,3,6,9-17H2,1-2H3/t22-/m0/s1