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

Systemtic Name: [4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-(3-methoxy-4-prop-2-enoxy-phenyl)methanone Openeye Name: (4-allyloxy-3-methoxy-phenyl)-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]methanone CAS Name: [4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-(3-methoxy-4-prop-2-enoxyphenyl)methanone IUPAC Name: [4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-(3-methoxy-4-prop-2-enoxyphenyl)methanone Traditional Name: (4-allyloxy-3-methoxy-phenyl)-(4-piperonylpiperazino)methanone Formula: C23H26N2O5 MolecularWeight: 410.46294

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(=O)N2CCN(CC2)CC3=CC4=C(C=C3)OCO4)OCC=C

Isomeric SMILES

COC1=C(C=CC(=C1)C(=O)N2CCN(CC2)CC3=CC4=C(C=C3)OCO4)OCC=C

InChI

InChI=1S/C23H26N2O5/c1-3-12-28-19-7-5-18(14-21(19)27-2)23(26)25-10-8-24(9-11-25)15-17-4-6-20-22(13-17)30-16-29-20/h3-7,13-14H,1,8-12,15-16H2,2H3