2-chloranyl-5-[[3,3-dimethyl-2-oxidanyl-2-(1,2,4-triazol-1-ylmethyl)cyclopentyl]methyl]phenol

Systemtic Name: 2-chloranyl-5-[[3,3-dimethyl-2-oxidanyl-2-(1,2,4-triazol-1-ylmethyl)cyclopentyl]methyl]phenol Openeye Name: 2-chloro-5-[[2-hydroxy-3,3-dimethyl-2-(1,2,4-triazol-1-ylmethyl)cyclopentyl]methyl]phenol CAS Name: 2-chloro-5-[[2-hydroxy-3,3-dimethyl-2-(1,2,4-triazol-1-ylmethyl)cyclopentyl]methyl]phenol IUPAC Name: 2-chloro-5-[[2-hydroxy-3,3-dimethyl-2-(1,2,4-triazol-1-ylmethyl)cyclopentyl]methyl]phenol Traditional Name: 2-chloro-5-[[2-hydroxy-3,3-dimethyl-2-(1,2,4-triazol-1-ylmethyl)cyclopentyl]methyl]phenol Formula: C17H22ClN3O2 MolecularWeight: 335.82848

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCC(C1(CN2C=NC=N2)O)CC3=CC(=C(C=C3)Cl)O)C

Isomeric SMILES

CC1(CCC(C1(CN2C=NC=N2)O)CC3=CC(=C(C=C3)Cl)O)C

InChI

InChI=1S/C17H22ClN3O2/c1-16(2)6-5-13(7-12-3-4-14(18)15(22)8-12)17(16,23)9-21-11-19-10-20-21/h3-4,8,10-11,13,22-23H,5-7,9H2,1-2H3