N-[1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-3-methyl-1-oxidanylidene-butan-2-yl]-2-phenoxy-ethanamide

Systemtic Name: N-[1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-3-methyl-1-oxidanylidene-butan-2-yl]-2-phenoxy-ethanamide Openeye Name: N-[1-[4-(1,3-benzodioxol-5-ylmethyl)piperazine-1-carbonyl]-2-methyl-propyl]-2-phenoxy-acetamide CAS Name: N-[1-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-3-methyl-1-oxobutan-2-yl]-2-phenoxyacetamide IUPAC Name: N-[1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-3-methyl-1-oxobutan-2-yl]-2-phenoxyacetamide Traditional Name: N-[2-methyl-1-(4-piperonylpiperazine-1-carbonyl)propyl]-2-phenoxy-acetamide Formula: C25H31N3O5 MolecularWeight: 453.53074

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)N1CCN(CC1)CC2=CC3=C(C=C2)OCO3)NC(=O)COC4=CC=CC=C4

Isomeric SMILES

CC(C)C(C(=O)N1CCN(CC1)CC2=CC3=C(C=C2)OCO3)NC(=O)COC4=CC=CC=C4

InChI

InChI=1S/C25H31N3O5/c1-18(2)24(26-23(29)16-31-20-6-4-3-5-7-20)25(30)28-12-10-27(11-13-28)15-19-8-9-21-22(14-19)33-17-32-21/h3-9,14,18,24H,10-13,15-17H2,1-2H3,(H,26,29)