N-[3-methyl-1-(3-methyl-4-octanoyl-piperazin-1-yl)-1-oxidanylidene-pentan-2-yl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[3-methyl-1-(3-methyl-4-octanoyl-piperazin-1-yl)-1-oxidanylidene-pentan-2-yl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[2-methyl-1-(3-methyl-4-octanoyl-piperazine-1-carbonyl)butyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[3-methyl-1-[3-methyl-4-(1-oxooctyl)-1-piperazinyl]-1-oxopentan-2-yl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[3-methyl-1-(3-methyl-4-octanoylpiperazin-1-yl)-1-oxopentan-2-yl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[1-(4-caprylyl-3-methyl-piperazine-1-carbonyl)-2-methyl-butyl]-piperonylamide Formula: C27H41N3O5 MolecularWeight: 487.63154

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)N1CCN(CC1C)C(=O)C(C(C)CC)NC(=O)C2=CC3=C(C=C2)OCO3

Isomeric SMILES

CCCCCCCC(=O)N1CCN(CC1C)C(=O)C(C(C)CC)NC(=O)C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C27H41N3O5/c1-5-7-8-9-10-11-24(31)30-15-14-29(17-20(30)4)27(33)25(19(3)6-2)28-26(32)21-12-13-22-23(16-21)35-18-34-22/h12-13,16,19-20,25H,5-11,14-15,17-18H2,1-4H3,(H,28,32)