4-[(E)-3-phenylprop-2-enyl]sulfanyl-1-[(2,3,4-trimethoxyphenyl)methyl]piperidine

Systemtic Name: 4-[(E)-3-phenylprop-2-enyl]sulfanyl-1-[(2,3,4-trimethoxyphenyl)methyl]piperidine Openeye Name: 4-[(E)-cinnamyl]sulfanyl-1-[(2,3,4-trimethoxyphenyl)methyl]piperidine CAS Name: 4-[[(E)-3-phenylprop-2-enyl]thio]-1-[(2,3,4-trimethoxyphenyl)methyl]piperidine IUPAC Name: 4-[(E)-3-phenylprop-2-enyl]sulfanyl-1-[(2,3,4-trimethoxyphenyl)methyl]piperidine Traditional Name: 4-[[(E)-cinnamyl]thio]-1-(2,3,4-trimethoxybenzyl)piperidine Formula: C24H31NO3S MolecularWeight: 413.57284

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)CN2CCC(CC2)SCC=CC3=CC=CC=C3)OC)OC

Isomeric SMILES

COC1=C(C(=C(C=C1)CN2CCC(CC2)SC/C=C/C3=CC=CC=C3)OC)OC

InChI

InChI=1S/C24H31NO3S/c1-26-22-12-11-20(23(27-2)24(22)28-3)18-25-15-13-21(14-16-25)29-17-7-10-19-8-5-4-6-9-19/h4-12,21H,13-18H2,1-3H3/b10-7+