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

Systemtic Name: 2-[2,6-bis(azanyl)hexanoylamino]-3-phenyl-propanoic acid hydrobromide Openeye Name: 2-(2,6-diaminohexanoylamino)-3-phenyl-propanoic acid hydrobromide CAS Name: 2-[(2,6-diamino-1-oxohexyl)amino]-3-phenylpropanoic acid hydrobromide IUPAC Name: 2-(2,6-diaminohexanoylamino)-3-phenylpropanoic acid hydrobromide Traditional Name: 2-(2,6-diaminohexanoylamino)-3-phenyl-propionic acid hydrobromide Formula: C15H24BrN3O3 MolecularWeight: 374.27336

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H23N3O3.BrH/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);1H