4-imidazol-1-yl-1-phenyl-butan-1-one hydrochloride

Systemtic Name: 4-imidazol-1-yl-1-phenyl-butan-1-one hydrochloride Openeye Name: 4-imidazol-1-yl-1-phenyl-butan-1-one hydrochloride CAS Name: 4-(1-imidazolyl)-1-phenyl-1-butanone hydrochloride IUPAC Name: 4-imidazol-1-yl-1-phenylbutan-1-one hydrochloride Traditional Name: 4-imidazol-1-yl-1-phenyl-butan-1-one hydrochloride Formula: C13H15ClN2O MolecularWeight: 250.724

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)CCCN2C=CN=C2.Cl

Isomeric SMILES

C1=CC=C(C=C1)C(=O)CCCN2C=CN=C2.Cl

InChI

InChI=1S/C13H14N2O.ClH/c16-13(12-5-2-1-3-6-12)7-4-9-15-10-8-14-11-15;/h1-3,5-6,8,10-11H,4,7,9H2;1H