1-[2-(benzotriazol-2-yl)-4-tert-butyl-3-oxidanyl-cyclohexa-1,3-dien-1-yl]propan-1-one

Systemtic Name: 1-[2-(benzotriazol-2-yl)-4-tert-butyl-3-oxidanyl-cyclohexa-1,3-dien-1-yl]propan-1-one Openeye Name: 1-[2-(benzotriazol-2-yl)-4-tert-butyl-3-hydroxy-cyclohexa-1,3-dien-1-yl]propan-1-one CAS Name: 1-[2-(2-benzotriazolyl)-4-tert-butyl-3-hydroxy-1-cyclohexa-1,3-dienyl]-1-propanone IUPAC Name: 1-[2-(benzotriazol-2-yl)-4-tert-butyl-3-hydroxycyclohexa-1,3-dien-1-yl]propan-1-one Traditional Name: 1-[2-(benzotriazol-2-yl)-4-tert-butyl-3-hydroxy-cyclohexa-1,3-dien-1-yl]propan-1-one Formula: C19H23N3O2 MolecularWeight: 325.40482

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=C(C(=C(CC1)C(C)(C)C)O)N2N=C3C=CC=CC3=N2

Isomeric SMILES

CCC(=O)C1=C(C(=C(CC1)C(C)(C)C)O)N2N=C3C=CC=CC3=N2

InChI

InChI=1S/C19H23N3O2/c1-5-16(23)12-10-11-13(19(2,3)4)18(24)17(12)22-20-14-8-6-7-9-15(14)21-22/h6-9,24H,5,10-11H2,1-4H3