1-[(2S)-2-methylbutyl]-4-[4-(2-methylphenyl)-1H-pyrazol-5-yl]piperidine

Systemtic Name: 1-[(2S)-2-methylbutyl]-4-[4-(2-methylphenyl)-1H-pyrazol-5-yl]piperidine Openeye Name: 1-[(2S)-2-methylbutyl]-4-[4-(o-tolyl)-1H-pyrazol-5-yl]piperidine CAS Name: 1-[(2S)-2-methylbutyl]-4-[4-(2-methylphenyl)-1H-pyrazol-5-yl]piperidine IUPAC Name: 1-[(2S)-2-methylbutyl]-4-[4-(2-methylphenyl)-1H-pyrazol-5-yl]piperidine Traditional Name: 1-[(2S)-2-methylbutyl]-4-[4-(o-tolyl)-1H-pyrazol-5-yl]piperidine Formula: C20H29N3 MolecularWeight: 311.46436

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)CN1CCC(CC1)C2=C(C=NN2)C3=CC=CC=C3C

Isomeric SMILES

CC[C@H](C)CN1CCC(CC1)C2=C(C=NN2)C3=CC=CC=C3C

InChI

InChI=1S/C20H29N3/c1-4-15(2)14-23-11-9-17(10-12-23)20-19(13-21-22-20)18-8-6-5-7-16(18)3/h5-8,13,15,17H,4,9-12,14H2,1-3H3,(H,21,22)/t15-/m0/s1