N-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methyl]-6-oxidanylidene-1-(phenylmethyl)pyridazine-3-carboxamide

Systemtic Name: N-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methyl]-6-oxidanylidene-1-(phenylmethyl)pyridazine-3-carboxamide Openeye Name: 1-benzyl-N-[(6-morpholinopyridin-1-ium-3-yl)methyl]-6-oxo-pyridazine-3-carboxamide CAS Name: N-[[6-(4-morpholinyl)-3-pyridin-1-iumyl]methyl]-6-oxo-1-(phenylmethyl)-3-pyridazinecarboxamide IUPAC Name: 1-benzyl-N-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methyl]-6-oxopyridazine-3-carboxamide Traditional Name: 1-benzyl-6-keto-N-[(6-morpholinopyridin-1-ium-3-yl)methyl]pyridazine-3-carboxamide Formula: C22H24N5O3+ MolecularWeight: 406.45766

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=[NH+]C=C(C=C2)CNC(=O)C3=NN(C(=O)C=C3)CC4=CC=CC=C4

Isomeric SMILES

C1COCCN1C2=[NH+]C=C(C=C2)CNC(=O)C3=NN(C(=O)C=C3)CC4=CC=CC=C4

InChI

InChI=1S/C22H23N5O3/c28-21-9-7-19(25-27(21)16-17-4-2-1-3-5-17)22(29)24-15-18-6-8-20(23-14-18)26-10-12-30-13-11-26/h1-9,14H,10-13,15-16H2,(H,24,29)/p+1