(E)-1-(4-butoxyphenyl)-5-(dimethylamino)pent-1-en-3-one hydrochloride

Systemtic Name: (E)-1-(4-butoxyphenyl)-5-(dimethylamino)pent-1-en-3-one hydrochloride Openeye Name: (E)-1-(4-butoxyphenyl)-5-(dimethylamino)pent-1-en-3-one hydrochloride CAS Name: (E)-1-(4-butoxyphenyl)-5-(dimethylamino)-1-penten-3-one hydrochloride IUPAC Name: (E)-1-(4-butoxyphenyl)-5-(dimethylamino)pent-1-en-3-one hydrochloride Traditional Name: (E)-1-(4-butoxyphenyl)-5-(dimethylamino)pent-1-en-3-one hydrochloride Formula: C17H26ClNO2 MolecularWeight: 311.84684

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C=CC(=O)CCN(C)C.Cl

Isomeric SMILES

CCCCOC1=CC=C(C=C1)/C=C/C(=O)CCN(C)C.Cl

InChI

InChI=1S/C17H25NO2.ClH/c1-4-5-14-20-17-10-7-15(8-11-17)6-9-16(19)12-13-18(2)3;/h6-11H,4-5,12-14H2,1-3H3;1H/b9-6+;