3-(1,3-benzodioxol-5-yloxymethyl)-1-(2-methylbutyl)-4-thiophen-3-yl-piperidine

Systemtic Name: 3-(1,3-benzodioxol-5-yloxymethyl)-1-(2-methylbutyl)-4-thiophen-3-yl-piperidine Openeye Name: 3-(1,3-benzodioxol-5-yloxymethyl)-1-(2-methylbutyl)-4-(3-thienyl)piperidine CAS Name: 3-(1,3-benzodioxol-5-yloxymethyl)-1-(2-methylbutyl)-4-(3-thiophenyl)piperidine IUPAC Name: 3-(1,3-benzodioxol-5-yloxymethyl)-1-(2-methylbutyl)-4-thiophen-3-ylpiperidine Traditional Name: 3-(1,3-benzodioxol-5-yloxymethyl)-1-(2-methylbutyl)-4-(3-thienyl)piperidine Formula: C22H29NO3S MolecularWeight: 387.53556

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)CN1CCC(C(C1)COC2=CC3=C(C=C2)OCO3)C4=CSC=C4

Isomeric SMILES

CCC(C)CN1CCC(C(C1)COC2=CC3=C(C=C2)OCO3)C4=CSC=C4

InChI

InChI=1S/C22H29NO3S/c1-3-16(2)11-23-8-6-20(17-7-9-27-14-17)18(12-23)13-24-19-4-5-21-22(10-19)26-15-25-21/h4-5,7,9-10,14,16,18,20H,3,6,8,11-13,15H2,1-2H3