3-[(4-aminophenyl)amino]azepan-2-one dihydrochloride

Systemtic Name: 3-[(4-aminophenyl)amino]azepan-2-one dihydrochloride Openeye Name: 3-(4-aminoanilino)azepan-2-one dihydrochloride CAS Name: 3-(4-aminoanilino)-2-azepanone dihydrochloride IUPAC Name: 3-(4-aminoanilino)azepan-2-one dihydrochloride Traditional Name: 3-(4-aminoanilino)azepan-2-one dihydrochloride Formula: C12H19Cl2N3O MolecularWeight: 292.20476

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Descriptors Computed from Structure

Canonical SMILES:

C1CCNC(=O)C(C1)NC2=CC=C(C=C2)N.Cl.Cl

Isomeric SMILES

C1CCNC(=O)C(C1)NC2=CC=C(C=C2)N.Cl.Cl

InChI

InChI=1S/C12H17N3O.2ClH/c13-9-4-6-10(7-5-9)15-11-3-1-2-8-14-12(11)16;;/h4-7,11,15H,1-3,8,13H2,(H,14,16);2*1H