methyl-[(4-morpholin-4-ylphenyl)methyl]-[(5-nitro-2-oxidanylidene-pyridin-1-yl)methyl]azanium

Systemtic Name: methyl-[(4-morpholin-4-ylphenyl)methyl]-[(5-nitro-2-oxidanylidene-pyridin-1-yl)methyl]azanium Openeye Name: methyl-[(4-morpholinophenyl)methyl]-[(5-nitro-2-oxo-1-pyridyl)methyl]ammonium CAS Name: methyl-[[4-(4-morpholinyl)phenyl]methyl]-[(5-nitro-2-oxo-1-pyridinyl)methyl]ammonium IUPAC Name: methyl-[(4-morpholin-4-ylphenyl)methyl]-[(5-nitro-2-oxopyridin-1-yl)methyl]azanium Traditional Name: (2-keto-5-nitro-1-pyridyl)methyl-methyl-(4-morpholinobenzyl)ammonium Formula: C18H23N4O4+ MolecularWeight: 359.39962

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=C(C=C1)N2CCOCC2)CN3C=C(C=CC3=O)[N+](=O)[O-]

Isomeric SMILES

C[NH+](CC1=CC=C(C=C1)N2CCOCC2)CN3C=C(C=CC3=O)[N+](=O)[O-]

InChI

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