(phenylmethyl) (2S)-2-[[(2S)-2-azanyl-4-methyl-pentanoyl]amino]propanoate hydrochloride

Systemtic Name: (phenylmethyl) (2S)-2-[[(2S)-2-azanyl-4-methyl-pentanoyl]amino]propanoate hydrochloride Openeye Name: benzyl (2S)-2-[[(2S)-2-amino-4-methyl-pentanoyl]amino]propanoate hydrochloride CAS Name: (2S)-2-[[(2S)-2-amino-4-methyl-1-oxopentyl]amino]propanoic acid (phenylmethyl) ester hydrochloride IUPAC Name: benzyl (2S)-2-[[(2S)-2-amino-4-methylpentanoyl]amino]propanoate hydrochloride Traditional Name: (2S)-2-[[(2S)-2-amino-4-methyl-pentanoyl]amino]propionic acid benzyl ester hydrochloride Formula: C16H25ClN2O3 MolecularWeight: 328.8343

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC(C)C(=O)OCC1=CC=CC=C1)N.Cl

Isomeric SMILES

C[C@@H](C(=O)OCC1=CC=CC=C1)NC(=O)[C@H](CC(C)C)N.Cl

InChI

InChI=1S/C16H24N2O3.ClH/c1-11(2)9-14(17)15(19)18-12(3)16(20)21-10-13-7-5-4-6-8-13;/h4-8,11-12,14H,9-10,17H2,1-3H3,(H,18,19);1H/t12-,14-;/m0./s1