5-(3-azanyl-1-phenyl-propyl)-4-(2-dimethylaminoethyl)-3-fluoranyl-6-oxidanylidene-cyclohexa-1,3-diene-1-carbonitrile dihydrochloride

Systemtic Name: 5-(3-azanyl-1-phenyl-propyl)-4-(2-dimethylaminoethyl)-3-fluoranyl-6-oxidanylidene-cyclohexa-1,3-diene-1-carbonitrile dihydrochloride Openeye Name: 5-(3-amino-1-phenyl-propyl)-4-(2-dimethylaminoethyl)-3-fluoro-6-oxo-cyclohexa-1,3-diene-1-carbonitrile dihydrochloride CAS Name: 5-(3-amino-1-phenylpropyl)-4-(2-dimethylaminoethyl)-3-fluoro-6-oxo-1-cyclohexa-1,3-dienecarbonitrile dihydrochloride IUPAC Name: 5-(3-amino-1-phenylpropyl)-4-(2-dimethylaminoethyl)-3-fluoro-6-oxocyclohexa-1,3-diene-1-carbonitrile dihydrochloride Traditional Name: 5-(3-amino-1-phenyl-propyl)-4-(2-dimethylaminoethyl)-3-fluoro-6-keto-cyclohexa-1,3-diene-1-carbonitrile dihydrochloride Formula: C20H26Cl2FN3O MolecularWeight: 414.344343

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCC1=C(C=C(C(=O)C1C(CCN)C2=CC=CC=C2)C#N)F.Cl.Cl

Isomeric SMILES

CN(C)CCC1=C(C=C(C(=O)C1C(CCN)C2=CC=CC=C2)C#N)F.Cl.Cl

InChI

InChI=1S/C20H24FN3O.2ClH/c1-24(2)11-9-17-18(21)12-15(13-23)20(25)19(17)16(8-10-22)14-6-4-3-5-7-14;;/h3-7,12,16,19H,8-11,22H2,1-2H3;2*1H