2-[1,3-benzodioxol-5-ylmethyl(cyclopentyl)amino]-N-(3-chloranyl-4-cyano-phenyl)ethanamide

Systemtic Name: 2-[1,3-benzodioxol-5-ylmethyl(cyclopentyl)amino]-N-(3-chloranyl-4-cyano-phenyl)ethanamide Openeye Name: 2-[1,3-benzodioxol-5-ylmethyl(cyclopentyl)amino]-N-(3-chloro-4-cyano-phenyl)acetamide CAS Name: 2-[1,3-benzodioxol-5-ylmethyl(cyclopentyl)amino]-N-(3-chloro-4-cyanophenyl)acetamide IUPAC Name: 2-[1,3-benzodioxol-5-ylmethyl(cyclopentyl)amino]-N-(3-chloro-4-cyanophenyl)acetamide Traditional Name: N-(3-chloro-4-cyano-phenyl)-2-[cyclopentyl(piperonyl)amino]acetamide Formula: C22H22ClN3O3 MolecularWeight: 411.88138

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N(CC2=CC3=C(C=C2)OCO3)CC(=O)NC4=CC(=C(C=C4)C#N)Cl

Isomeric SMILES

C1CCC(C1)N(CC2=CC3=C(C=C2)OCO3)CC(=O)NC4=CC(=C(C=C4)C#N)Cl

InChI

InChI=1S/C22H22ClN3O3/c23-19-10-17(7-6-16(19)11-24)25-22(27)13-26(18-3-1-2-4-18)12-15-5-8-20-21(9-15)29-14-28-20/h5-10,18H,1-4,12-14H2,(H,25,27)