6-(1-azanylethyl)-3-(3-chloranyl-4-methoxy-phenyl)-2H-1,2,4-triazin-5-one hydrochloride

Systemtic Name: 6-(1-azanylethyl)-3-(3-chloranyl-4-methoxy-phenyl)-2H-1,2,4-triazin-5-one hydrochloride Openeye Name: 6-(1-aminoethyl)-3-(3-chloro-4-methoxy-phenyl)-2H-1,2,4-triazin-5-one hydrochloride CAS Name: 6-(1-aminoethyl)-3-(3-chloro-4-methoxyphenyl)-2H-1,2,4-triazin-5-one hydrochloride IUPAC Name: 6-(1-aminoethyl)-3-(3-chloro-4-methoxyphenyl)-2H-1,2,4-triazin-5-one hydrochloride Traditional Name: 6-(1-aminoethyl)-3-(3-chloro-4-methoxy-phenyl)-2H-1,2,4-triazin-5-one hydrochloride Formula: C12H14Cl2N4O2 MolecularWeight: 317.17116

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NNC(=NC1=O)C2=CC(=C(C=C2)OC)Cl)N.Cl

Isomeric SMILES

CC(C1=NNC(=NC1=O)C2=CC(=C(C=C2)OC)Cl)N.Cl

InChI

InChI=1S/C12H13ClN4O2.ClH/c1-6(14)10-12(18)15-11(17-16-10)7-3-4-9(19-2)8(13)5-7;/h3-6H,14H2,1-2H3,(H,15,17,18);1H