[(1R)-1-(benzotriazol-1-yl)propyl] (3R)-3,5,5-trimethylhexanoate

Systemtic Name: [(1R)-1-(benzotriazol-1-yl)propyl] (3R)-3,5,5-trimethylhexanoate Openeye Name: [(1R)-1-(benzotriazol-1-yl)propyl] (3R)-3,5,5-trimethylhexanoate CAS Name: (3R)-3,5,5-trimethylhexanoic acid [(1R)-1-(1-benzotriazolyl)propyl] ester IUPAC Name: [(1R)-1-(benzotriazol-1-yl)propyl] (3R)-3,5,5-trimethylhexanoate Traditional Name: (3R)-3,5,5-trimethylhexanoic acid [(1R)-1-(benzotriazol-1-yl)propyl] ester Formula: C18H27N3O2 MolecularWeight: 317.42588

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Descriptors Computed from Structure

Canonical SMILES:

CCC(N1C2=CC=CC=C2N=N1)OC(=O)CC(C)CC(C)(C)C

Isomeric SMILES

CC[C@H](N1C2=CC=CC=C2N=N1)OC(=O)C[C@H](C)CC(C)(C)C

InChI

InChI=1S/C18H27N3O2/c1-6-16(21-15-10-8-7-9-14(15)19-20-21)23-17(22)11-13(2)12-18(3,4)5/h7-10,13,16H,6,11-12H2,1-5H3/t13-,16+/m0/s1