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

Systemtic Name: (1S)-1-(benzotriazol-1-yl)-3,3-dimethyl-1-pyridin-4-yl-butan-2-one Openeye Name: (1S)-1-(benzotriazol-1-yl)-3,3-dimethyl-1-(4-pyridyl)butan-2-one CAS Name: (1S)-1-(1-benzotriazolyl)-3,3-dimethyl-1-pyridin-4-yl-2-butanone IUPAC Name: (1S)-1-(benzotriazol-1-yl)-3,3-dimethyl-1-pyridin-4-ylbutan-2-one Traditional Name: (1S)-1-(benzotriazol-1-yl)-3,3-dimethyl-1-(4-pyridyl)butan-2-one Formula: C17H18N4O MolecularWeight: 294.35102

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(C)(C)C(=O)[C@H](C1=CC=NC=C1)N2C3=CC=CC=C3N=N2

InChI

InChI=1S/C17H18N4O/c1-17(2,3)16(22)15(12-8-10-18-11-9-12)21-14-7-5-4-6-13(14)19-20-21/h4-11,15H,1-3H3/t15-/m0/s1