(5E)-5-[(3-bromanyl-4-methoxy-phenyl)methylidene]-2-(dimethylaminomethyl)-2-methyl-cyclopentan-1-one hydrochloride

Systemtic Name: (5E)-5-[(3-bromanyl-4-methoxy-phenyl)methylidene]-2-(dimethylaminomethyl)-2-methyl-cyclopentan-1-one hydrochloride Openeye Name: (5E)-5-[(3-bromo-4-methoxy-phenyl)methylene]-2-(dimethylaminomethyl)-2-methyl-cyclopentanone hydrochloride CAS Name: (5E)-5-[(3-bromo-4-methoxyphenyl)methylidene]-2-(dimethylaminomethyl)-2-methyl-1-cyclopentanone hydrochloride IUPAC Name: (5E)-5-[(3-bromo-4-methoxyphenyl)methylidene]-2-(dimethylaminomethyl)-2-methylcyclopentan-1-one hydrochloride Traditional Name: (5E)-5-(3-bromo-4-methoxy-benzylidene)-2-(dimethylaminomethyl)-2-methyl-cyclopentanone hydrochloride Formula: C17H23BrClNO2 MolecularWeight: 388.72702

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCC(=CC2=CC(=C(C=C2)OC)Br)C1=O)CN(C)C.Cl

Isomeric SMILES

CC1(CC/C(=C\C2=CC(=C(C=C2)OC)Br)/C1=O)CN(C)C.Cl

InChI

InChI=1S/C17H22BrNO2.ClH/c1-17(11-19(2)3)8-7-13(16(17)20)9-12-5-6-15(21-4)14(18)10-12;/h5-6,9-10H,7-8,11H2,1-4H3;1H/b13-9+;