3-benzamido-4-[[1-(2-carboxyethylamino)-3-methyl-1-oxidanylidene-butan-2-yl]amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 3-benzamido-4-[[1-(2-carboxyethylamino)-3-methyl-1-oxidanylidene-butan-2-yl]amino]-4-oxidanylidene-butanoic acid Openeye Name: 3-benzamido-4-[[1-(2-carboxyethylcarbamoyl)-2-methyl-propyl]amino]-4-oxo-butanoic acid CAS Name: 3-benzamido-4-[[1-(2-carboxyethylamino)-3-methyl-1-oxobutan-2-yl]amino]-4-oxobutanoic acid IUPAC Name: 3-benzamido-4-[[1-(2-carboxyethylamino)-3-methyl-1-oxobutan-2-yl]amino]-4-oxobutanoic acid Traditional Name: 3-benzamido-4-[[1-(2-carboxyethylcarbamoyl)-2-methyl-propyl]amino]-4-keto-butyric acid Formula: C19H25N3O7 MolecularWeight: 407.4177

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H25N3O7/c1-11(2)16(19(29)20-9-8-14(23)24)22-18(28)13(10-15(25)26)21-17(27)12-6-4-3-5-7-12/h3-7,11,13,16H,8-10H2,1-2H3,(H,20,29)(H,21,27)(H,22,28)(H,23,24)(H,25,26)