N-[(1-methylimidazol-2-yl)methyl]-N-(2-morpholin-4-ium-4-ylethyl)-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[(1-methylimidazol-2-yl)methyl]-N-(2-morpholin-4-ium-4-ylethyl)-1,3-benzodioxole-5-carboxamide Openeye Name: N-[(1-methylimidazol-2-yl)methyl]-N-(2-morpholin-4-ium-4-ylethyl)-1,3-benzodioxole-5-carboxamide CAS Name: N-[(1-methyl-2-imidazolyl)methyl]-N-[2-(4-morpholin-4-iumyl)ethyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[(1-methylimidazol-2-yl)methyl]-N-(2-morpholin-4-ium-4-ylethyl)-1,3-benzodioxole-5-carboxamide Traditional Name: N-[(1-methylimidazol-2-yl)methyl]-N-(2-morpholin-4-ium-4-ylethyl)-piperonylamide Formula: C19H25N4O4+ MolecularWeight: 373.4262

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1CN(CC[NH+]2CCOCC2)C(=O)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

CN1C=CN=C1CN(CC[NH+]2CCOCC2)C(=O)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C19H24N4O4/c1-21-5-4-20-18(21)13-23(7-6-22-8-10-25-11-9-22)19(24)15-2-3-16-17(12-15)27-14-26-16/h2-5,12H,6-11,13-14H2,1H3/p+1