(2S)-2-[[(3S)-3-azanyl-2-oxidanylidene-4-phenyl-butanoyl]amino]-4-methyl-pentanoic acid

Systemtic Name: (2S)-2-[[(3S)-3-azanyl-2-oxidanylidene-4-phenyl-butanoyl]amino]-4-methyl-pentanoic acid Openeye Name: (2S)-2-[[(3S)-3-amino-2-oxo-4-phenyl-butanoyl]amino]-4-methyl-pentanoic acid CAS Name: (2S)-2-[[(3S)-3-amino-1,2-dioxo-4-phenylbutyl]amino]-4-methylpentanoic acid IUPAC Name: (2S)-2-[[(3S)-3-amino-2-oxo-4-phenylbutanoyl]amino]-4-methylpentanoic acid Traditional Name: (2S)-2-[[(3S)-3-amino-2-keto-4-phenyl-butanoyl]amino]-4-methyl-valeric acid Formula: C16H22N2O4 MolecularWeight: 306.35688

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(C)C[C@@H](C(=O)O)NC(=O)C(=O)[C@H](CC1=CC=CC=C1)N

InChI

InChI=1S/C16H22N2O4/c1-10(2)8-13(16(21)22)18-15(20)14(19)12(17)9-11-6-4-3-5-7-11/h3-7,10,12-13H,8-9,17H2,1-2H3,(H,18,20)(H,21,22)/t12-,13-/m0/s1