1-[3-(1,3-benzodioxol-5-yl)-3-phenoxy-propyl]-4-(phenylmethyl)piperazine

Systemtic Name: 1-[3-(1,3-benzodioxol-5-yl)-3-phenoxy-propyl]-4-(phenylmethyl)piperazine Openeye Name: 1-[3-(1,3-benzodioxol-5-yl)-3-phenoxy-propyl]-4-benzyl-piperazine CAS Name: 1-[3-(1,3-benzodioxol-5-yl)-3-phenoxypropyl]-4-(phenylmethyl)piperazine IUPAC Name: 1-[3-(1,3-benzodioxol-5-yl)-3-phenoxypropyl]-4-benzylpiperazine Traditional Name: 1-[3-(1,3-benzodioxol-5-yl)-3-phenoxy-propyl]-4-benzyl-piperazine Formula: C27H30N2O3 MolecularWeight: 430.5387

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCC(C2=CC3=C(C=C2)OCO3)OC4=CC=CC=C4)CC5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1CCC(C2=CC3=C(C=C2)OCO3)OC4=CC=CC=C4)CC5=CC=CC=C5

InChI

InChI=1S/C27H30N2O3/c1-3-7-22(8-4-1)20-29-17-15-28(16-18-29)14-13-25(32-24-9-5-2-6-10-24)23-11-12-26-27(19-23)31-21-30-26/h1-12,19,25H,13-18,20-21H2