2-[2,6-bis(azanyl)hexanoylamino]-3-phenyl-propanoic acid dihydrochloride

Systemtic Name: 2-[2,6-bis(azanyl)hexanoylamino]-3-phenyl-propanoic acid dihydrochloride Openeye Name: 2-(2,6-diaminohexanoylamino)-3-phenyl-propanoic acid dihydrochloride CAS Name: 2-[(2,6-diamino-1-oxohexyl)amino]-3-phenylpropanoic acid dihydrochloride IUPAC Name: 2-(2,6-diaminohexanoylamino)-3-phenylpropanoic acid dihydrochloride Traditional Name: 2-(2,6-diaminohexanoylamino)-3-phenyl-propionic acid dihydrochloride Formula: C15H25Cl2N3O3 MolecularWeight: 366.2833

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H23N3O3.2ClH/c16-9-5-4-8-12(17)14(19)18-13(15(20)21)10-11-6-2-1-3-7-11;;/h1-3,6-7,12-13H,4-5,8-10,16-17H2,(H,18,19)(H,20,21);2*1H