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

Systemtic Name: [4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-[4-(2-methylpropoxy)phenyl]methanone Openeye Name: [4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-(4-isobutoxyphenyl)methanone CAS Name: [4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-[4-(2-methylpropoxy)phenyl]methanone IUPAC Name: [4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-[4-(2-methylpropoxy)phenyl]methanone Traditional Name: (4-isobutoxyphenyl)-(4-piperonylpiperazino)methanone Formula: C23H28N2O4 MolecularWeight: 396.47942

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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