N-[2-[4-(3-cyclohexylpropanoyl)piperazin-1-yl]ethyl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[2-[4-(3-cyclohexylpropanoyl)piperazin-1-yl]ethyl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[2-[4-(3-cyclohexylpropanoyl)piperazin-1-yl]ethyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[2-[4-(3-cyclohexyl-1-oxopropyl)-1-piperazinyl]ethyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[2-[4-(3-cyclohexylpropanoyl)piperazin-1-yl]ethyl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[2-[4-(3-cyclohexylpropanoyl)piperazino]ethyl]-piperonylamide Formula: C23H33N3O4 MolecularWeight: 415.52582

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CCC(=O)N2CCN(CC2)CCNC(=O)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1CCC(CC1)CCC(=O)N2CCN(CC2)CCNC(=O)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C23H33N3O4/c27-22(9-6-18-4-2-1-3-5-18)26-14-12-25(13-15-26)11-10-24-23(28)19-7-8-20-21(16-19)30-17-29-20/h7-8,16,18H,1-6,9-15,17H2,(H,24,28)