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

Systemtic Name: 6-azanyl-N-[1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-3-methyl-1-oxidanylidene-butan-2-yl]hexanamide Openeye Name: 6-amino-N-[1-[4-(1,3-benzodioxol-5-ylmethyl)piperazine-1-carbonyl]-2-methyl-propyl]hexanamide CAS Name: 6-amino-N-[1-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-3-methyl-1-oxobutan-2-yl]hexanamide IUPAC Name: 6-amino-N-[1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-3-methyl-1-oxobutan-2-yl]hexanamide Traditional Name: 6-amino-N-[2-methyl-1-(4-piperonylpiperazine-1-carbonyl)propyl]hexanamide Formula: C23H36N4O4 MolecularWeight: 432.55634

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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)CCCCCN

Isomeric SMILES

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

InChI

InChI=1S/C23H36N4O4/c1-17(2)22(25-21(28)6-4-3-5-9-24)23(29)27-12-10-26(11-13-27)15-18-7-8-19-20(14-18)31-16-30-19/h7-8,14,17,22H,3-6,9-13,15-16,24H2,1-2H3,(H,25,28)