(phenylmethyl) (3S)-3-[[(2S)-2-azanyl-4-methyl-pentanoyl]amino]-2-oxidanylidene-butanoate

Systemtic Name: (phenylmethyl) (3S)-3-[[(2S)-2-azanyl-4-methyl-pentanoyl]amino]-2-oxidanylidene-butanoate Openeye Name: benzyl (3S)-3-[[(2S)-2-amino-4-methyl-pentanoyl]amino]-2-oxo-butanoate CAS Name: (3S)-3-[[(2S)-2-amino-4-methyl-1-oxopentyl]amino]-2-oxobutanoic acid (phenylmethyl) ester IUPAC Name: benzyl (3S)-3-[[(2S)-2-amino-4-methylpentanoyl]amino]-2-oxobutanoate Traditional Name: (3S)-3-[[(2S)-2-amino-4-methyl-pentanoyl]amino]-2-keto-butyric acid benzyl ester Formula: C17H24N2O4 MolecularWeight: 320.38346

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H24N2O4/c1-11(2)9-14(18)16(21)19-12(3)15(20)17(22)23-10-13-7-5-4-6-8-13/h4-8,11-12,14H,9-10,18H2,1-3H3,(H,19,21)/t12-,14-/m0/s1