(Z)-1-(benzotriazol-1-yl)-4,4-dimethyl-1-(4-methylphenyl)pent-1-en-3-one

Systemtic Name: (Z)-1-(benzotriazol-1-yl)-4,4-dimethyl-1-(4-methylphenyl)pent-1-en-3-one Openeye Name: (Z)-1-(benzotriazol-1-yl)-4,4-dimethyl-1-(p-tolyl)pent-1-en-3-one CAS Name: (Z)-1-(1-benzotriazolyl)-4,4-dimethyl-1-(4-methylphenyl)-1-penten-3-one IUPAC Name: (Z)-1-(benzotriazol-1-yl)-4,4-dimethyl-1-(4-methylphenyl)pent-1-en-3-one Traditional Name: (Z)-1-(benzotriazol-1-yl)-4,4-dimethyl-1-(p-tolyl)pent-1-en-3-one Formula: C20H21N3O MolecularWeight: 319.40024

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=CC(=O)C(C)(C)C)N2C3=CC=CC=C3N=N2

Isomeric SMILES

CC1=CC=C(C=C1)/C(=C/C(=O)C(C)(C)C)/N2C3=CC=CC=C3N=N2

InChI

InChI=1S/C20H21N3O/c1-14-9-11-15(12-10-14)18(13-19(24)20(2,3)4)23-17-8-6-5-7-16(17)21-22-23/h5-13H,1-4H3/b18-13-