1-(4-chloranylnaphthalen-1-yl)-3-(dibutylamino)propan-1-one hydrochloride

Systemtic Name: 1-(4-chloranylnaphthalen-1-yl)-3-(dibutylamino)propan-1-one hydrochloride Openeye Name: 1-(4-chloro-1-naphthyl)-3-(dibutylamino)propan-1-one hydrochloride CAS Name: 1-(4-chloro-1-naphthalenyl)-3-(dibutylamino)-1-propanone hydrochloride IUPAC Name: 1-(4-chloronaphthalen-1-yl)-3-(dibutylamino)propan-1-one hydrochloride Traditional Name: 1-(4-chloro-1-naphthyl)-3-(dibutylamino)propan-1-one hydrochloride Formula: C21H29Cl2NO MolecularWeight: 382.36706

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCC)CCC(=O)C1=CC=C(C2=CC=CC=C21)Cl.Cl

Isomeric SMILES

CCCCN(CCCC)CCC(=O)C1=CC=C(C2=CC=CC=C21)Cl.Cl

InChI

InChI=1S/C21H28ClNO.ClH/c1-3-5-14-23(15-6-4-2)16-13-21(24)19-11-12-20(22)18-10-8-7-9-17(18)19;/h7-12H,3-6,13-16H2,1-2H3;1H