2-[[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]methyl]-4-methoxy-6-prop-2-enyl-phenol

Systemtic Name: 2-[[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]methyl]-4-methoxy-6-prop-2-enyl-phenol Openeye Name: 2-allyl-6-[[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]methyl]-4-methoxy-phenol CAS Name: 2-[[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]methyl]-4-methoxy-6-prop-2-enylphenol IUPAC Name: 2-[[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]methyl]-4-methoxy-6-prop-2-enylphenol Traditional Name: 2-allyl-4-methoxy-6-[(4-piperonylpiperazino)methyl]phenol Formula: C23H28N2O4 MolecularWeight: 396.47942

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C(=C1)CC=C)O)CN2CCN(CC2)CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

COC1=CC(=C(C(=C1)CC=C)O)CN2CCN(CC2)CC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C23H28N2O4/c1-3-4-18-12-20(27-2)13-19(23(18)26)15-25-9-7-24(8-10-25)14-17-5-6-21-22(11-17)29-16-28-21/h3,5-6,11-13,26H,1,4,7-10,14-16H2,2H3