4-[3-(1,3-benzodioxol-5-yloxymethyl)-1-pentyl-piperidin-4-yl]-N,N-dimethyl-aniline

Systemtic Name: 4-[3-(1,3-benzodioxol-5-yloxymethyl)-1-pentyl-piperidin-4-yl]-N,N-dimethyl-aniline Openeye Name: 4-[3-(1,3-benzodioxol-5-yloxymethyl)-1-pentyl-4-piperidyl]-N,N-dimethyl-aniline CAS Name: 4-[3-(1,3-benzodioxol-5-yloxymethyl)-1-pentyl-4-piperidinyl]-N,N-dimethylaniline IUPAC Name: 4-[3-(1,3-benzodioxol-5-yloxymethyl)-1-pentylpiperidin-4-yl]-N,N-dimethylaniline Traditional Name: [4-[1-amyl-3-(1,3-benzodioxol-5-yloxymethyl)-4-piperidyl]phenyl]-dimethyl-amine Formula: C26H36N2O3 MolecularWeight: 424.57564

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1CCC(C(C1)COC2=CC3=C(C=C2)OCO3)C4=CC=C(C=C4)N(C)C

Isomeric SMILES

CCCCCN1CCC(C(C1)COC2=CC3=C(C=C2)OCO3)C4=CC=C(C=C4)N(C)C

InChI

InChI=1S/C26H36N2O3/c1-4-5-6-14-28-15-13-24(20-7-9-22(10-8-20)27(2)3)21(17-28)18-29-23-11-12-25-26(16-23)31-19-30-25/h7-12,16,21,24H,4-6,13-15,17-19H2,1-3H3