(3R,4S)-1-hexyl-3,4-dimethyl-4-(3-prop-2-enoxyphenyl)piperidine

Systemtic Name: (3R,4S)-1-hexyl-3,4-dimethyl-4-(3-prop-2-enoxyphenyl)piperidine Openeye Name: (3R,4S)-4-(3-allyloxyphenyl)-1-hexyl-3,4-dimethyl-piperidine CAS Name: (3R,4S)-1-hexyl-3,4-dimethyl-4-(3-prop-2-enoxyphenyl)piperidine IUPAC Name: (3R,4S)-1-hexyl-3,4-dimethyl-4-(3-prop-2-enoxyphenyl)piperidine Traditional Name: (3R,4S)-4-(3-allyloxyphenyl)-1-hexyl-3,4-dimethyl-piperidine Formula: C22H35NO MolecularWeight: 329.5194

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1CCC(C(C1)C)(C)C2=CC(=CC=C2)OCC=C

Isomeric SMILES

CCCCCCN1CC[C@]([C@H](C1)C)(C)C2=CC(=CC=C2)OCC=C

InChI

InChI=1S/C22H35NO/c1-5-7-8-9-14-23-15-13-22(4,19(3)18-23)20-11-10-12-21(17-20)24-16-6-2/h6,10-12,17,19H,2,5,7-9,13-16,18H2,1,3-4H3/t19-,22-/m0/s1