2-[1,3-benzodioxol-5-ylmethyl(2-chloranylethanoyl)amino]-N-cycloheptyl-2-(4-methylphenyl)ethanamide

Systemtic Name: 2-[1,3-benzodioxol-5-ylmethyl(2-chloranylethanoyl)amino]-N-cycloheptyl-2-(4-methylphenyl)ethanamide Openeye Name: 2-[1,3-benzodioxol-5-ylmethyl-(2-chloroacetyl)amino]-N-cycloheptyl-2-(p-tolyl)acetamide CAS Name: 2-[1,3-benzodioxol-5-ylmethyl-(2-chloro-1-oxoethyl)amino]-N-cycloheptyl-2-(4-methylphenyl)acetamide IUPAC Name: 2-[1,3-benzodioxol-5-ylmethyl-(2-chloroacetyl)amino]-N-cycloheptyl-2-(4-methylphenyl)acetamide Traditional Name: 2-[(2-chloroacetyl)-piperonyl-amino]-N-cycloheptyl-2-(p-tolyl)acetamide Formula: C26H31ClN2O4 MolecularWeight: 470.98834

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C(=O)NC2CCCCCC2)N(CC3=CC4=C(C=C3)OCO4)C(=O)CCl

Isomeric SMILES

CC1=CC=C(C=C1)C(C(=O)NC2CCCCCC2)N(CC3=CC4=C(C=C3)OCO4)C(=O)CCl

InChI

InChI=1S/C26H31ClN2O4/c1-18-8-11-20(12-9-18)25(26(31)28-21-6-4-2-3-5-7-21)29(24(30)15-27)16-19-10-13-22-23(14-19)33-17-32-22/h8-14,21,25H,2-7,15-17H2,1H3,(H,28,31)