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

Systemtic Name: 1-[3-(1,3-benzodioxol-5-yl)-3-(3-methoxyphenoxy)propyl]-4-(phenylmethyl)piperazine Openeye Name: 1-[3-(1,3-benzodioxol-5-yl)-3-(3-methoxyphenoxy)propyl]-4-benzyl-piperazine CAS Name: 1-[3-(1,3-benzodioxol-5-yl)-3-(3-methoxyphenoxy)propyl]-4-(phenylmethyl)piperazine IUPAC Name: 1-[3-(1,3-benzodioxol-5-yl)-3-(3-methoxyphenoxy)propyl]-4-benzylpiperazine Traditional Name: 1-[3-(1,3-benzodioxol-5-yl)-3-(3-methoxyphenoxy)propyl]-4-benzyl-piperazine Formula: C28H32N2O4 MolecularWeight: 460.56468

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC=C1)OC(CCN2CCN(CC2)CC3=CC=CC=C3)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

COC1=CC(=CC=C1)OC(CCN2CCN(CC2)CC3=CC=CC=C3)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C28H32N2O4/c1-31-24-8-5-9-25(19-24)34-26(23-10-11-27-28(18-23)33-21-32-27)12-13-29-14-16-30(17-15-29)20-22-6-3-2-4-7-22/h2-11,18-19,26H,12-17,20-21H2,1H3