2-[[2-[2-[(2-azanyl-4-oxidanyl-4-oxidanylidene-butanoyl)amino]propanoylamino]-3-phenyl-propanoyl]amino]-3-methyl-butanoic acid

Systemtic Name: 2-[[2-[2-[(2-azanyl-4-oxidanyl-4-oxidanylidene-butanoyl)amino]propanoylamino]-3-phenyl-propanoyl]amino]-3-methyl-butanoic acid Openeye Name: 2-[[2-[2-[(2-amino-4-hydroxy-4-oxo-butanoyl)amino]propanoylamino]-3-phenyl-propanoyl]amino]-3-methyl-butanoic acid CAS Name: 2-[[2-[[2-[(2-amino-4-hydroxy-1,4-dioxobutyl)amino]-1-oxopropyl]amino]-1-oxo-3-phenylpropyl]amino]-3-methylbutanoic acid IUPAC Name: 2-[[2-[2-[(2-amino-4-hydroxy-4-oxobutanoyl)amino]propanoylamino]-3-phenylpropanoyl]amino]-3-methylbutanoic acid Traditional Name: 2-[[2-[2-[(2-amino-4-hydroxy-4-keto-butanoyl)amino]propanoylamino]-3-phenyl-propanoyl]amino]-3-methyl-butyric acid Formula: C21H30N4O7 MolecularWeight: 450.4855

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H30N4O7/c1-11(2)17(21(31)32)25-20(30)15(9-13-7-5-4-6-8-13)24-18(28)12(3)23-19(29)14(22)10-16(26)27/h4-8,11-12,14-15,17H,9-10,22H2,1-3H3,(H,23,29)(H,24,28)(H,25,30)(H,26,27)(H,31,32)