3-[2-[(2-azanyl-3-methyl-butanoyl)amino]propanoylamino]-4-(1,3-benzoxazol-2-yl)-4-oxidanylidene-butanoic acid

Systemtic Name: 3-[2-[(2-azanyl-3-methyl-butanoyl)amino]propanoylamino]-4-(1,3-benzoxazol-2-yl)-4-oxidanylidene-butanoic acid Openeye Name: 3-[2-[(2-amino-3-methyl-butanoyl)amino]propanoylamino]-4-(1,3-benzoxazol-2-yl)-4-oxo-butanoic acid CAS Name: 3-[[2-[(2-amino-3-methyl-1-oxobutyl)amino]-1-oxopropyl]amino]-4-(1,3-benzoxazol-2-yl)-4-oxobutanoic acid IUPAC Name: 3-[2-[(2-amino-3-methylbutanoyl)amino]propanoylamino]-4-(1,3-benzoxazol-2-yl)-4-oxobutanoic acid Traditional Name: 3-[2-[(2-amino-3-methyl-butanoyl)amino]propanoylamino]-4-(1,3-benzoxazol-2-yl)-4-keto-butyric acid Formula: C19H24N4O6 MolecularWeight: 404.41706

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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)C1=NC2=CC=CC=C2O1)N

Isomeric SMILES

CC(C)C(C(=O)NC(C)C(=O)NC(CC(=O)O)C(=O)C1=NC2=CC=CC=C2O1)N

InChI

InChI=1S/C19H24N4O6/c1-9(2)15(20)18(28)21-10(3)17(27)22-12(8-14(24)25)16(26)19-23-11-6-4-5-7-13(11)29-19/h4-7,9-10,12,15H,8,20H2,1-3H3,(H,21,28)(H,22,27)(H,24,25)