2-[(2S)-butan-2-yl]-6-(1,2,4-triazol-1-ylmethyl)phenol

Systemtic Name: 2-[(2S)-butan-2-yl]-6-(1,2,4-triazol-1-ylmethyl)phenol Openeye Name: 2-[(1S)-1-methylpropyl]-6-(1,2,4-triazol-1-ylmethyl)phenol CAS Name: 2-[(2S)-butan-2-yl]-6-(1,2,4-triazol-1-ylmethyl)phenol IUPAC Name: 2-[(2S)-butan-2-yl]-6-(1,2,4-triazol-1-ylmethyl)phenol Traditional Name: 2-[(1S)-1-methylpropyl]-6-(1,2,4-triazol-1-ylmethyl)phenol Formula: C13H17N3O MolecularWeight: 231.29358

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=CC(=C1O)CN2C=NC=N2

Isomeric SMILES

CC[C@H](C)C1=CC=CC(=C1O)CN2C=NC=N2

InChI

InChI=1S/C13H17N3O/c1-3-10(2)12-6-4-5-11(13(12)17)7-16-9-14-8-15-16/h4-6,8-10,17H,3,7H2,1-2H3/t10-/m0/s1