1-(2-aminophenyl)-3,7-bis(azanyl)heptan-2-one hydrochloride

Systemtic Name: 1-(2-aminophenyl)-3,7-bis(azanyl)heptan-2-one hydrochloride Openeye Name: 3,7-diamino-1-(2-aminophenyl)heptan-2-one hydrochloride CAS Name: 3,7-diamino-1-(2-aminophenyl)-2-heptanone hydrochloride IUPAC Name: 3,7-diamino-1-(2-aminophenyl)heptan-2-one hydrochloride Traditional Name: 3,7-diamino-1-(2-aminophenyl)heptan-2-one hydrochloride Formula: C13H22ClN3O MolecularWeight: 271.78628

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CC(=O)C(CCCCN)N)N.Cl

Isomeric SMILES

C1=CC=C(C(=C1)CC(=O)C(CCCCN)N)N.Cl

InChI

InChI=1S/C13H21N3O.ClH/c14-8-4-3-7-12(16)13(17)9-10-5-1-2-6-11(10)15;/h1-2,5-6,12H,3-4,7-9,14-16H2;1H