1-[(E)-3-(4-methoxyphenyl)-3-methylsulfanyl-1-phenyl-prop-2-enyl]piperidine

Systemtic Name: 1-[(E)-3-(4-methoxyphenyl)-3-methylsulfanyl-1-phenyl-prop-2-enyl]piperidine Openeye Name: 1-[(E)-3-(4-methoxyphenyl)-3-methylsulfanyl-1-phenyl-allyl]piperidine CAS Name: 1-[(E)-3-(4-methoxyphenyl)-3-(methylthio)-1-phenylprop-2-enyl]piperidine IUPAC Name: 1-[(E)-3-(4-methoxyphenyl)-3-methylsulfanyl-1-phenylprop-2-enyl]piperidine Traditional Name: 1-[(E)-3-(4-methoxyphenyl)-3-(methylthio)-1-phenyl-allyl]piperidine Formula: C22H27NOS MolecularWeight: 353.52088

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=CC(C2=CC=CC=C2)N3CCCCC3)SC

Isomeric SMILES

COC1=CC=C(C=C1)/C(=C\C(C2=CC=CC=C2)N3CCCCC3)/SC

InChI

InChI=1S/C22H27NOS/c1-24-20-13-11-19(12-14-20)22(25-2)17-21(18-9-5-3-6-10-18)23-15-7-4-8-16-23/h3,5-6,9-14,17,21H,4,7-8,15-16H2,1-2H3/b22-17+