3-[[6-[(4-chlorophenyl)methyl]-5-oxidanylidene-2H-1,2,4-triazin-3-yl]amino]propyl-dimethyl-azanium

Systemtic Name: 3-[[6-[(4-chlorophenyl)methyl]-5-oxidanylidene-2H-1,2,4-triazin-3-yl]amino]propyl-dimethyl-azanium Openeye Name: 3-[[6-[(4-chlorophenyl)methyl]-5-oxo-2H-1,2,4-triazin-3-yl]amino]propyl-dimethyl-ammonium CAS Name: 3-[[6-[(4-chlorophenyl)methyl]-5-oxo-2H-1,2,4-triazin-3-yl]amino]propyl-dimethylammonium IUPAC Name: 3-[[6-[(4-chlorophenyl)methyl]-5-oxo-2H-1,2,4-triazin-3-yl]amino]propyl-dimethylazanium Traditional Name: 3-[[6-(4-chlorobenzyl)-5-keto-2H-1,2,4-triazin-3-yl]amino]propyl-dimethyl-ammonium Formula: C15H21ClN5O+ MolecularWeight: 322.81314

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCCNC1=NC(=O)C(=NN1)CC2=CC=C(C=C2)Cl

Isomeric SMILES

C[NH+](C)CCCNC1=NC(=O)C(=NN1)CC2=CC=C(C=C2)Cl

InChI

InChI=1S/C15H20ClN5O/c1-21(2)9-3-8-17-15-18-14(22)13(19-20-15)10-11-4-6-12(16)7-5-11/h4-7H,3,8-10H2,1-2H3,(H2,17,18,20,22)/p+1