N-[[4-[(2-methylpropylcarbamoylamino)methyl]cyclohexyl]methyl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[[4-[(2-methylpropylcarbamoylamino)methyl]cyclohexyl]methyl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[[4-[(isobutylcarbamoylamino)methyl]cyclohexyl]methyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[[4-[[[(2-methylpropylamino)-oxomethyl]amino]methyl]cyclohexyl]methyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[[4-[(2-methylpropylcarbamoylamino)methyl]cyclohexyl]methyl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[[4-[(isobutylcarbamoylamino)methyl]cyclohexyl]methyl]-piperonylamide Formula: C21H31N3O4 MolecularWeight: 389.48854

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)NCC1CCC(CC1)CNC(=O)C2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC(C)CNC(=O)NCC1CCC(CC1)CNC(=O)C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C21H31N3O4/c1-14(2)10-23-21(26)24-12-16-5-3-15(4-6-16)11-22-20(25)17-7-8-18-19(9-17)28-13-27-18/h7-9,14-16H,3-6,10-13H2,1-2H3,(H,22,25)(H2,23,24,26)