N-[(2R)-2-(4-methoxyphenyl)-2-morpholin-4-ium-4-yl-ethyl]-6-oxidanylidene-1H-pyridazine-3-carboxamide

Systemtic Name: N-[(2R)-2-(4-methoxyphenyl)-2-morpholin-4-ium-4-yl-ethyl]-6-oxidanylidene-1H-pyridazine-3-carboxamide Openeye Name: N-[(2R)-2-(4-methoxyphenyl)-2-morpholin-4-ium-4-yl-ethyl]-6-oxo-1H-pyridazine-3-carboxamide CAS Name: N-[(2R)-2-(4-methoxyphenyl)-2-(4-morpholin-4-iumyl)ethyl]-6-oxo-1H-pyridazine-3-carboxamide IUPAC Name: N-[(2R)-2-(4-methoxyphenyl)-2-morpholin-4-ium-4-ylethyl]-6-oxo-1H-pyridazine-3-carboxamide Traditional Name: 6-keto-N-[(2R)-2-(4-methoxyphenyl)-2-morpholin-4-ium-4-yl-ethyl]-1H-pyridazine-3-carboxamide Formula: C18H23N4O4+ MolecularWeight: 359.39962

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(CNC(=O)C2=NNC(=O)C=C2)[NH+]3CCOCC3

Isomeric SMILES

COC1=CC=C(C=C1)[C@H](CNC(=O)C2=NNC(=O)C=C2)[NH+]3CCOCC3

InChI

InChI=1S/C18H22N4O4/c1-25-14-4-2-13(3-5-14)16(22-8-10-26-11-9-22)12-19-18(24)15-6-7-17(23)21-20-15/h2-7,16H,8-12H2,1H3,(H,19,24)(H,21,23)/p+1/t16-/m0/s1