1-[1,3-benzodioxol-5-ylmethyl(2-chloranylethanoyl)amino]-N-cycloheptyl-cyclohexane-1-carboxamide

Systemtic Name: 1-[1,3-benzodioxol-5-ylmethyl(2-chloranylethanoyl)amino]-N-cycloheptyl-cyclohexane-1-carboxamide Openeye Name: 1-[1,3-benzodioxol-5-ylmethyl-(2-chloroacetyl)amino]-N-cycloheptyl-cyclohexanecarboxamide CAS Name: 1-[1,3-benzodioxol-5-ylmethyl-(2-chloro-1-oxoethyl)amino]-N-cycloheptyl-1-cyclohexanecarboxamide IUPAC Name: 1-[1,3-benzodioxol-5-ylmethyl-(2-chloroacetyl)amino]-N-cycloheptylcyclohexane-1-carboxamide Traditional Name: 1-[(2-chloroacetyl)-piperonyl-amino]-N-cycloheptyl-cyclohexanecarboxamide Formula: C24H33ClN2O4 MolecularWeight: 448.98282

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)NC(=O)C2(CCCCC2)N(CC3=CC4=C(C=C3)OCO4)C(=O)CCl

Isomeric SMILES

C1CCCC(CC1)NC(=O)C2(CCCCC2)N(CC3=CC4=C(C=C3)OCO4)C(=O)CCl

InChI

InChI=1S/C24H33ClN2O4/c25-15-22(28)27(16-18-10-11-20-21(14-18)31-17-30-20)24(12-6-3-7-13-24)23(29)26-19-8-4-1-2-5-9-19/h10-11,14,19H,1-9,12-13,15-17H2,(H,26,29)