4-benzamido-5-[[1-(2-carboxyethylamino)-3-methyl-1-oxidanylidene-butan-2-yl]amino]-5-oxidanylidene-pentanoic acid

Systemtic Name: 4-benzamido-5-[[1-(2-carboxyethylamino)-3-methyl-1-oxidanylidene-butan-2-yl]amino]-5-oxidanylidene-pentanoic acid Openeye Name: 4-benzamido-5-[[1-(2-carboxyethylcarbamoyl)-2-methyl-propyl]amino]-5-oxo-pentanoic acid CAS Name: 4-benzamido-5-[[1-(2-carboxyethylamino)-3-methyl-1-oxobutan-2-yl]amino]-5-oxopentanoic acid IUPAC Name: 4-benzamido-5-[[1-(2-carboxyethylamino)-3-methyl-1-oxobutan-2-yl]amino]-5-oxopentanoic acid Traditional Name: 4-benzamido-5-[[1-(2-carboxyethylcarbamoyl)-2-methyl-propyl]amino]-5-keto-valeric acid Formula: C20H27N3O7 MolecularWeight: 421.44428

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H27N3O7/c1-12(2)17(20(30)21-11-10-16(26)27)23-19(29)14(8-9-15(24)25)22-18(28)13-6-4-3-5-7-13/h3-7,12,14,17H,8-11H2,1-2H3,(H,21,30)(H,22,28)(H,23,29)(H,24,25)(H,26,27)