2-ethyl-3,3-dimethyl-1-phenyl-butan-1-one hydrochloride

Systemtic Name: 2-ethyl-3,3-dimethyl-1-phenyl-butan-1-one hydrochloride Openeye Name: 2-ethyl-3,3-dimethyl-1-phenyl-butan-1-one hydrochloride CAS Name: 2-ethyl-3,3-dimethyl-1-phenyl-1-butanone hydrochloride IUPAC Name: 2-ethyl-3,3-dimethyl-1-phenylbutan-1-one hydrochloride Traditional Name: 2-ethyl-3,3-dimethyl-1-phenyl-butan-1-one hydrochloride Formula: C14H21ClO MolecularWeight: 240.76894

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)C1=CC=CC=C1)C(C)(C)C.Cl

Isomeric SMILES

CCC(C(=O)C1=CC=CC=C1)C(C)(C)C.Cl

InChI

InChI=1S/C14H20O.ClH/c1-5-12(14(2,3)4)13(15)11-9-7-6-8-10-11;/h6-10,12H,5H2,1-4H3;1H