4-chloranyl-2-[3-(3,4-dimethoxyphenyl)-1H-1,2,4-triazol-5-yl]aniline

Systemtic Name: 4-chloranyl-2-[3-(3,4-dimethoxyphenyl)-1H-1,2,4-triazol-5-yl]aniline Openeye Name: 4-chloro-2-[3-(3,4-dimethoxyphenyl)-1H-1,2,4-triazol-5-yl]aniline CAS Name: 4-chloro-2-[3-(3,4-dimethoxyphenyl)-1H-1,2,4-triazol-5-yl]aniline IUPAC Name: 4-chloro-2-[3-(3,4-dimethoxyphenyl)-1H-1,2,4-triazol-5-yl]aniline Traditional Name: [4-chloro-2-[3-(3,4-dimethoxyphenyl)-1H-1,2,4-triazol-5-yl]phenyl]amine Formula: C16H15ClN4O2 MolecularWeight: 330.7689

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NNC(=N2)C3=C(C=CC(=C3)Cl)N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NNC(=N2)C3=C(C=CC(=C3)Cl)N)OC

InChI

InChI=1S/C16H15ClN4O2/c1-22-13-6-3-9(7-14(13)23-2)15-19-16(21-20-15)11-8-10(17)4-5-12(11)18/h3-8H,18H2,1-2H3,(H,19,20,21)