1-(4-chloranyl-5-phenoxy-1,2,3-triazol-1-yl)-3,3-dimethyl-butan-2-one

Systemtic Name: 1-(4-chloranyl-5-phenoxy-1,2,3-triazol-1-yl)-3,3-dimethyl-butan-2-one Openeye Name: 1-(4-chloro-5-phenoxy-triazol-1-yl)-3,3-dimethyl-butan-2-one CAS Name: 1-(4-chloro-5-phenoxy-1-triazolyl)-3,3-dimethyl-2-butanone IUPAC Name: 1-(4-chloro-5-phenoxytriazol-1-yl)-3,3-dimethylbutan-2-one Traditional Name: 1-(4-chloro-5-phenoxy-triazol-1-yl)-3,3-dimethyl-butan-2-one Formula: C14H16ClN3O2 MolecularWeight: 293.74874

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)CN1C(=C(N=N1)Cl)OC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)C(=O)CN1C(=C(N=N1)Cl)OC2=CC=CC=C2

InChI

InChI=1S/C14H16ClN3O2/c1-14(2,3)11(19)9-18-13(12(15)16-17-18)20-10-7-5-4-6-8-10/h4-8H,9H2,1-3H3