2-[(2-azanyl-3-phenyl-propanoyl)amino]-3-methyl-butanamide trihydrochloride

Systemtic Name: 2-[(2-azanyl-3-phenyl-propanoyl)amino]-3-methyl-butanamide trihydrochloride Openeye Name: 2-[(2-amino-3-phenyl-propanoyl)amino]-3-methyl-butanamide trihydrochloride CAS Name: 2-[(2-amino-1-oxo-3-phenylpropyl)amino]-3-methylbutanamide trihydrochloride IUPAC Name: 2-[(2-amino-3-phenylpropanoyl)amino]-3-methylbutanamide trihydrochloride Traditional Name: 3-methyl-2-(phenylalanylamino)butyramide trihydrochloride Formula: C14H24Cl3N3O2 MolecularWeight: 372.71826

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)N)NC(=O)C(CC1=CC=CC=C1)N.Cl.Cl.Cl

Isomeric SMILES

CC(C)C(C(=O)N)NC(=O)C(CC1=CC=CC=C1)N.Cl.Cl.Cl

InChI

InChI=1S/C14H21N3O2.3ClH/c1-9(2)12(13(16)18)17-14(19)11(15)8-10-6-4-3-5-7-10;;;/h3-7,9,11-12H,8,15H2,1-2H3,(H2,16,18)(H,17,19);3*1H