2-[[1-(carboxymethylamino)-3-(1H-imidazol-5-yl)-1-oxidanylidene-propan-2-yl]amino]-4-methyl-pentanoic acid

Systemtic Name: 2-[[1-(carboxymethylamino)-3-(1H-imidazol-5-yl)-1-oxidanylidene-propan-2-yl]amino]-4-methyl-pentanoic acid Openeye Name: 2-[[2-(carboxymethylamino)-1-(1H-imidazol-5-ylmethyl)-2-oxo-ethyl]amino]-4-methyl-pentanoic acid CAS Name: 2-[[1-(carboxymethylamino)-3-(1H-imidazol-5-yl)-1-oxopropan-2-yl]amino]-4-methylpentanoic acid IUPAC Name: 2-[[1-(carboxymethylamino)-3-(1H-imidazol-5-yl)-1-oxopropan-2-yl]amino]-4-methylpentanoic acid Traditional Name: 2-[[2-(carboxymethylamino)-1-(1H-imidazol-5-ylmethyl)-2-keto-ethyl]amino]-4-methyl-valeric acid Formula: C14H22N4O5 MolecularWeight: 326.34828

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)O)NC(CC1=CN=CN1)C(=O)NCC(=O)O

Isomeric SMILES

CC(C)CC(C(=O)O)NC(CC1=CN=CN1)C(=O)NCC(=O)O

InChI

InChI=1S/C14H22N4O5/c1-8(2)3-11(14(22)23)18-10(4-9-5-15-7-17-9)13(21)16-6-12(19)20/h5,7-8,10-11,18H,3-4,6H2,1-2H3,(H,15,17)(H,16,21)(H,19,20)(H,22,23)