N3-(3-chloranyl-4-fluoranyl-phenyl)-5-morpholin-4-yl-N1-phenyl-benzene-1,3-diamine hydrochloride

Systemtic Name: N3-(3-chloranyl-4-fluoranyl-phenyl)-5-morpholin-4-yl-N1-phenyl-benzene-1,3-diamine hydrochloride Openeye Name: N3-(3-chloro-4-fluoro-phenyl)-5-morpholino-N1-phenyl-benzene-1,3-diamine hydrochloride CAS Name: N3-(3-chloro-4-fluorophenyl)-5-(4-morpholinyl)-N1-phenylbenzene-1,3-diamine hydrochloride IUPAC Name: 3-N-(3-chloro-4-fluorophenyl)-5-morpholin-4-yl-1-N-phenylbenzene-1,3-diamine hydrochloride Traditional Name: (3-anilino-5-morpholino-phenyl)-(3-chloro-4-fluoro-phenyl)amine hydrochloride Formula: C22H22Cl2FN3O MolecularWeight: 434.333983

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=CC(=CC(=C2)NC3=CC(=C(C=C3)F)Cl)NC4=CC=CC=C4.Cl

Isomeric SMILES

C1COCCN1C2=CC(=CC(=C2)NC3=CC(=C(C=C3)F)Cl)NC4=CC=CC=C4.Cl

InChI

InChI=1S/C22H21ClFN3O.ClH/c23-21-15-17(6-7-22(21)24)26-19-12-18(25-16-4-2-1-3-5-16)13-20(14-19)27-8-10-28-11-9-27;/h1-7,12-15,25-26H,8-11H2;1H