(5S,6S)-6-(benzotriazol-1-yl)-5-phenyl-3-(2-phenylethenyl)cyclohex-2-en-1-one

Systemtic Name: (5S,6S)-6-(benzotriazol-1-yl)-5-phenyl-3-(2-phenylethenyl)cyclohex-2-en-1-one Openeye Name: (5S,6S)-6-(benzotriazol-1-yl)-5-phenyl-3-styryl-cyclohex-2-en-1-one CAS Name: (5S,6S)-6-(1-benzotriazolyl)-5-phenyl-3-(2-phenylethenyl)-1-cyclohex-2-enone IUPAC Name: (5S,6S)-6-(benzotriazol-1-yl)-5-phenyl-3-(2-phenylethenyl)cyclohex-2-en-1-one Traditional Name: (5S,6S)-6-(benzotriazol-1-yl)-5-phenyl-3-styryl-cyclohex-2-en-1-one Formula: C26H21N3O MolecularWeight: 391.46444

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(C(=O)C=C1C=CC2=CC=CC=C2)N3C4=CC=CC=C4N=N3)C5=CC=CC=C5

Isomeric SMILES

C1[C@H]([C@@H](C(=O)C=C1C=CC2=CC=CC=C2)N3C4=CC=CC=C4N=N3)C5=CC=CC=C5

InChI

InChI=1S/C26H21N3O/c30-25-18-20(16-15-19-9-3-1-4-10-19)17-22(21-11-5-2-6-12-21)26(25)29-24-14-8-7-13-23(24)27-28-29/h1-16,18,22,26H,17H2/t22-,26-/m0/s1