[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-[2-(2-phenoxyethoxy)phenyl]methanone

Systemtic Name: [4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-[2-(2-phenoxyethoxy)phenyl]methanone Openeye Name: [4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-[2-(2-phenoxyethoxy)phenyl]methanone CAS Name: [4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-[2-(2-phenoxyethoxy)phenyl]methanone IUPAC Name: [4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-[2-(2-phenoxyethoxy)phenyl]methanone Traditional Name: [2-(2-phenoxyethoxy)phenyl]-(4-piperonylpiperazino)methanone Formula: C27H28N2O5 MolecularWeight: 460.52162

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C(=O)C4=CC=CC=C4OCCOC5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C(=O)C4=CC=CC=C4OCCOC5=CC=CC=C5

InChI

InChI=1S/C27H28N2O5/c30-27(23-8-4-5-9-24(23)32-17-16-31-22-6-2-1-3-7-22)29-14-12-28(13-15-29)19-21-10-11-25-26(18-21)34-20-33-25/h1-11,18H,12-17,19-20H2