2-(benzotriazol-1-yl)-N-[(1R,2R,3S)-2,3-dimethylcyclohexyl]ethanamide

Systemtic Name: 2-(benzotriazol-1-yl)-N-[(1R,2R,3S)-2,3-dimethylcyclohexyl]ethanamide Openeye Name: 2-(benzotriazol-1-yl)-N-[(1R,2R,3S)-2,3-dimethylcyclohexyl]acetamide CAS Name: 2-(1-benzotriazolyl)-N-[(1R,2R,3S)-2,3-dimethylcyclohexyl]acetamide IUPAC Name: 2-(benzotriazol-1-yl)-N-[(1R,2R,3S)-2,3-dimethylcyclohexyl]acetamide Traditional Name: 2-(benzotriazol-1-yl)-N-[(1R,2R,3S)-2,3-dimethylcyclohexyl]acetamide Formula: C16H22N4O MolecularWeight: 286.37208

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1C)NC(=O)CN2C3=CC=CC=C3N=N2

Isomeric SMILES

C[C@H]1CCC[C@H]([C@@H]1C)NC(=O)CN2C3=CC=CC=C3N=N2

InChI

InChI=1S/C16H22N4O/c1-11-6-5-8-13(12(11)2)17-16(21)10-20-15-9-4-3-7-14(15)18-19-20/h3-4,7,9,11-13H,5-6,8,10H2,1-2H3,(H,17,21)/t11-,12+,13+/m0/s1