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

Systemtic Name: N-[1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-3-methyl-1-oxidanylidene-butan-2-yl]butanamide Openeye Name: N-[1-[4-(1,3-benzodioxol-5-ylmethyl)piperazine-1-carbonyl]-2-methyl-propyl]butanamide CAS Name: N-[1-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-3-methyl-1-oxobutan-2-yl]butanamide IUPAC Name: N-[1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-3-methyl-1-oxobutan-2-yl]butanamide Traditional Name: N-[2-methyl-1-(4-piperonylpiperazine-1-carbonyl)propyl]butyramide Formula: C21H31N3O4 MolecularWeight: 389.48854

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC(C(C)C)C(=O)N1CCN(CC1)CC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CCCC(=O)NC(C(C)C)C(=O)N1CCN(CC1)CC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C21H31N3O4/c1-4-5-19(25)22-20(15(2)3)21(26)24-10-8-23(9-11-24)13-16-6-7-17-18(12-16)28-14-27-17/h6-7,12,15,20H,4-5,8-11,13-14H2,1-3H3,(H,22,25)