N-(1,3-benzodioxol-5-ylmethoxy)-1-[2-(4-methylsulfanylphenyl)cyclopenten-1-yl]ethanimine

Systemtic Name: N-(1,3-benzodioxol-5-ylmethoxy)-1-[2-(4-methylsulfanylphenyl)cyclopenten-1-yl]ethanimine Openeye Name: N-(1,3-benzodioxol-5-ylmethoxy)-1-[2-(4-methylsulfanylphenyl)cyclopenten-1-yl]ethanimine CAS Name: N-(1,3-benzodioxol-5-ylmethoxy)-1-[2-[4-(methylthio)phenyl]-1-cyclopentenyl]ethanimine IUPAC Name: N-(1,3-benzodioxol-5-ylmethoxy)-1-[2-(4-methylsulfanylphenyl)cyclopenten-1-yl]ethanimine Traditional Name: (E)-1-[2-[4-(methylthio)phenyl]cyclopenten-1-yl]ethylidene-piperonyloxy-amine Formula: C22H23NO3S MolecularWeight: 381.48792

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NOCC1=CC2=C(C=C1)OCO2)C3=C(CCC3)C4=CC=C(C=C4)SC

Isomeric SMILES

C/C(=N\OCC1=CC2=C(C=C1)OCO2)/C3=C(CCC3)C4=CC=C(C=C4)SC

InChI

InChI=1S/C22H23NO3S/c1-15(23-26-13-16-6-11-21-22(12-16)25-14-24-21)19-4-3-5-20(19)17-7-9-18(27-2)10-8-17/h6-12H,3-5,13-14H2,1-2H3/b23-15+