4-[2-(6-methyl-1,2,4-triazin-5-yl)-1-(4-nitrophenyl)ethyl]-4-oxidanidyl-morpholin-4-ium

Systemtic Name: 4-[2-(6-methyl-1,2,4-triazin-5-yl)-1-(4-nitrophenyl)ethyl]-4-oxidanidyl-morpholin-4-ium Openeye Name: 4-[2-(6-methyl-1,2,4-triazin-5-yl)-1-(4-nitrophenyl)ethyl]-4-oxido-morpholin-4-ium CAS Name: 4-[2-(6-methyl-1,2,4-triazin-5-yl)-1-(4-nitrophenyl)ethyl]-4-oxidomorpholin-4-ium IUPAC Name: 4-[2-(6-methyl-1,2,4-triazin-5-yl)-1-(4-nitrophenyl)ethyl]-4-oxidomorpholin-4-ium Traditional Name: 4-[2-(6-methyl-1,2,4-triazin-5-yl)-1-(4-nitrophenyl)ethyl]-4-oxido-morpholin-4-ium Formula: C16H19N5O4 MolecularWeight: 345.35316

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=CN=N1)CC(C2=CC=C(C=C2)[N+](=O)[O-])[N+]3(CCOCC3)[O-]

Isomeric SMILES

CC1=C(N=CN=N1)CC(C2=CC=C(C=C2)[N+](=O)[O-])[N+]3(CCOCC3)[O-]

InChI

InChI=1S/C16H19N5O4/c1-12-15(17-11-18-19-12)10-16(21(24)6-8-25-9-7-21)13-2-4-14(5-3-13)20(22)23/h2-5,11,16H,6-10H2,1H3