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

Systemtic Name: N-[1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-4-methyl-1-oxidanylidene-pentan-2-yl]-2-methyl-benzamide Openeye Name: N-[1-[4-(1,3-benzodioxol-5-ylmethyl)piperazine-1-carbonyl]-3-methyl-butyl]-2-methyl-benzamide CAS Name: N-[1-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-4-methyl-1-oxopentan-2-yl]-2-methylbenzamide IUPAC Name: N-[1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-4-methyl-1-oxopentan-2-yl]-2-methylbenzamide Traditional Name: 2-methyl-N-[3-methyl-1-(4-piperonylpiperazine-1-carbonyl)butyl]benzamide Formula: C26H33N3O4 MolecularWeight: 451.55792

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)NC(CC(C)C)C(=O)N2CCN(CC2)CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1=CC=CC=C1C(=O)NC(CC(C)C)C(=O)N2CCN(CC2)CC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C26H33N3O4/c1-18(2)14-22(27-25(30)21-7-5-4-6-19(21)3)26(31)29-12-10-28(11-13-29)16-20-8-9-23-24(15-20)33-17-32-23/h4-9,15,18,22H,10-14,16-17H2,1-3H3,(H,27,30)