N-[(2-morpholin-4-ylpyridin-1-ium-4-yl)methyl]-6-oxidanylidene-1-(2-phenoxyethyl)pyridazine-3-carboxamide

Systemtic Name: N-[(2-morpholin-4-ylpyridin-1-ium-4-yl)methyl]-6-oxidanylidene-1-(2-phenoxyethyl)pyridazine-3-carboxamide Openeye Name: N-[(2-morpholinopyridin-1-ium-4-yl)methyl]-6-oxo-1-(2-phenoxyethyl)pyridazine-3-carboxamide CAS Name: N-[[2-(4-morpholinyl)-4-pyridin-1-iumyl]methyl]-6-oxo-1-(2-phenoxyethyl)-3-pyridazinecarboxamide IUPAC Name: N-[(2-morpholin-4-ylpyridin-1-ium-4-yl)methyl]-6-oxo-1-(2-phenoxyethyl)pyridazine-3-carboxamide Traditional Name: 6-keto-N-[(2-morpholinopyridin-1-ium-4-yl)methyl]-1-(2-phenoxyethyl)pyridazine-3-carboxamide Formula: C23H26N5O4+ MolecularWeight: 436.48364

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=[NH+]C=CC(=C2)CNC(=O)C3=NN(C(=O)C=C3)CCOC4=CC=CC=C4

Isomeric SMILES

C1COCCN1C2=[NH+]C=CC(=C2)CNC(=O)C3=NN(C(=O)C=C3)CCOC4=CC=CC=C4

InChI

InChI=1S/C23H25N5O4/c29-22-7-6-20(26-28(22)12-15-32-19-4-2-1-3-5-19)23(30)25-17-18-8-9-24-21(16-18)27-10-13-31-14-11-27/h1-9,16H,10-15,17H2,(H,25,30)/p+1