3-[2-[(2-benzamido-3-methyl-butanoyl)amino]propanoylamino]-4-oxidanylidene-butanoic acid

Systemtic Name: 3-[2-[(2-benzamido-3-methyl-butanoyl)amino]propanoylamino]-4-oxidanylidene-butanoic acid Openeye Name: 3-[2-[(2-benzamido-3-methyl-butanoyl)amino]propanoylamino]-4-oxo-butanoic acid CAS Name: 3-[[2-[(2-benzamido-3-methyl-1-oxobutyl)amino]-1-oxopropyl]amino]-4-oxobutanoic acid IUPAC Name: 3-[2-[(2-benzamido-3-methylbutanoyl)amino]propanoylamino]-4-oxobutanoic acid Traditional Name: 3-[2-[(2-benzamido-3-methyl-butanoyl)amino]propanoylamino]-4-keto-butyric acid Formula: C19H25N3O6 MolecularWeight: 391.4183

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H25N3O6/c1-11(2)16(22-18(27)13-7-5-4-6-8-13)19(28)20-12(3)17(26)21-14(10-23)9-15(24)25/h4-8,10-12,14,16H,9H2,1-3H3,(H,20,28)(H,21,26)(H,22,27)(H,24,25)