1-[(4-chlorophenyl)methoxy]-3,3-dimethyl-1-(1,2,4-triazol-1-yl)butan-2-one

Systemtic Name: 1-[(4-chlorophenyl)methoxy]-3,3-dimethyl-1-(1,2,4-triazol-1-yl)butan-2-one Openeye Name: 1-[(4-chlorophenyl)methoxy]-3,3-dimethyl-1-(1,2,4-triazol-1-yl)butan-2-one CAS Name: 1-[(4-chlorophenyl)methoxy]-3,3-dimethyl-1-(1,2,4-triazol-1-yl)-2-butanone IUPAC Name: 1-[(4-chlorophenyl)methoxy]-3,3-dimethyl-1-(1,2,4-triazol-1-yl)butan-2-one Traditional Name: 1-(4-chlorobenzyl)oxy-3,3-dimethyl-1-(1,2,4-triazol-1-yl)butan-2-one Formula: C15H18ClN3O2 MolecularWeight: 307.77532

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)C(N1C=NC=N1)OCC2=CC=C(C=C2)Cl

Isomeric SMILES

CC(C)(C)C(=O)C(N1C=NC=N1)OCC2=CC=C(C=C2)Cl

InChI

InChI=1S/C15H18ClN3O2/c1-15(2,3)13(20)14(19-10-17-9-18-19)21-8-11-4-6-12(16)7-5-11/h4-7,9-10,14H,8H2,1-3H3