1-[4-azanyl-2-(5-methyl-2-oxidanyl-phenyl)benzotriazol-5-yl]-2-methyl-prop-2-en-1-one

Systemtic Name: 1-[4-azanyl-2-(5-methyl-2-oxidanyl-phenyl)benzotriazol-5-yl]-2-methyl-prop-2-en-1-one Openeye Name: 1-[4-amino-2-(2-hydroxy-5-methyl-phenyl)benzotriazol-5-yl]-2-methyl-prop-2-en-1-one CAS Name: 1-[4-amino-2-(2-hydroxy-5-methylphenyl)-5-benzotriazolyl]-2-methyl-2-propen-1-one IUPAC Name: 1-[4-amino-2-(2-hydroxy-5-methylphenyl)benzotriazol-5-yl]-2-methylprop-2-en-1-one Traditional Name: 1-[4-amino-2-(2-hydroxy-5-methyl-phenyl)benzotriazol-5-yl]-2-methyl-prop-2-en-1-one Formula: C17H16N4O2 MolecularWeight: 308.33454

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)O)N2N=C3C=CC(=C(C3=N2)N)C(=O)C(=C)C

Isomeric SMILES

CC1=CC(=C(C=C1)O)N2N=C3C=CC(=C(C3=N2)N)C(=O)C(=C)C

InChI

InChI=1S/C17H16N4O2/c1-9(2)17(23)11-5-6-12-16(15(11)18)20-21(19-12)13-8-10(3)4-7-14(13)22/h4-8,22H,1,18H2,2-3H3