N-(2-methyl-4-piperazin-1-ylcarbonyl-phenyl)-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-(2-methyl-4-piperazin-1-ylcarbonyl-phenyl)-1,3-benzodioxole-5-carboxamide Openeye Name: N-[2-methyl-4-(piperazine-1-carbonyl)phenyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[2-methyl-4-[oxo(1-piperazinyl)methyl]phenyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[2-methyl-4-(piperazine-1-carbonyl)phenyl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[2-methyl-4-(piperazine-1-carbonyl)phenyl]-piperonylamide Formula: C20H21N3O4 MolecularWeight: 367.39844

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)N2CCNCC2)NC(=O)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)N2CCNCC2)NC(=O)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C20H21N3O4/c1-13-10-15(20(25)23-8-6-21-7-9-23)2-4-16(13)22-19(24)14-3-5-17-18(11-14)27-12-26-17/h2-5,10-11,21H,6-9,12H2,1H3,(H,22,24)