(3S)-4-(benzotriazol-1-yl)-1,3-diphenyl-butan-2-one

Systemtic Name: (3S)-4-(benzotriazol-1-yl)-1,3-diphenyl-butan-2-one Openeye Name: (3S)-4-(benzotriazol-1-yl)-1,3-diphenyl-butan-2-one CAS Name: (3S)-4-(1-benzotriazolyl)-1,3-diphenyl-2-butanone IUPAC Name: (3S)-4-(benzotriazol-1-yl)-1,3-diphenylbutan-2-one Traditional Name: (3S)-4-(benzotriazol-1-yl)-1,3-diphenyl-butan-2-one Formula: C22H19N3O MolecularWeight: 341.40576

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(=O)C(CN2C3=CC=CC=C3N=N2)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CC(=O)[C@H](CN2C3=CC=CC=C3N=N2)C4=CC=CC=C4

InChI

InChI=1S/C22H19N3O/c26-22(15-17-9-3-1-4-10-17)19(18-11-5-2-6-12-18)16-25-21-14-8-7-13-20(21)23-24-25/h1-14,19H,15-16H2/t19-/m1/s1