N-[5-[(4-azanylcyclohexyl)carbamoyl]-2-chloranyl-phenyl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[5-[(4-azanylcyclohexyl)carbamoyl]-2-chloranyl-phenyl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[5-[(4-aminocyclohexyl)carbamoyl]-2-chloro-phenyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[5-[[(4-aminocyclohexyl)amino]-oxomethyl]-2-chlorophenyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[5-[(4-aminocyclohexyl)carbamoyl]-2-chlorophenyl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[5-[(4-aminocyclohexyl)carbamoyl]-2-chloro-phenyl]-piperonylamide Formula: C21H22ClN3O4 MolecularWeight: 415.87008

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1N)NC(=O)C2=CC(=C(C=C2)Cl)NC(=O)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1CC(CCC1N)NC(=O)C2=CC(=C(C=C2)Cl)NC(=O)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C21H22ClN3O4/c22-16-7-1-12(20(26)24-15-5-3-14(23)4-6-15)9-17(16)25-21(27)13-2-8-18-19(10-13)29-11-28-18/h1-2,7-10,14-15H,3-6,11,23H2,(H,24,26)(H,25,27)