propyl N-(1,3-benzodioxol-5-ylcarbonyl)-N'-[3-(dimethylamino)propyl]carbamimidate

Systemtic Name: propyl N-(1,3-benzodioxol-5-ylcarbonyl)-N'-[3-(dimethylamino)propyl]carbamimidate Openeye Name: N-[N-[3-(dimethylamino)propyl]-C-propoxy-carbonimidoyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[1,3-benzodioxol-5-yl(oxo)methyl]-N'-[3-(dimethylamino)propyl]carbamimidic acid propyl ester IUPAC Name: propyl N-(1,3-benzodioxole-5-carbonyl)-N'-[3-(dimethylamino)propyl]carbamimidate Traditional Name: N-[N-[3-(dimethylamino)propyl]-C-propoxy-carbonimidoyl]-piperonylamide Formula: C17H25N3O4 MolecularWeight: 335.3981

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=NCCCN(C)C)NC(=O)C1=CC2=C(C=C1)OCO2

Isomeric SMILES

CCCOC(=NCCCN(C)C)NC(=O)C1=CC2=C(C=C1)OCO2

InChI

InChI=1S/C17H25N3O4/c1-4-10-22-17(18-8-5-9-20(2)3)19-16(21)13-6-7-14-15(11-13)24-12-23-14/h6-7,11H,4-5,8-10,12H2,1-3H3,(H,18,19,21)