2-[[1-[2-[(2-azanyl-4-oxidanyl-4-oxidanylidene-butanoyl)amino]propanoyl]pyrrolidin-2-yl]carbonylamino]-3-methyl-pentanoic acid

Systemtic Name: 2-[[1-[2-[(2-azanyl-4-oxidanyl-4-oxidanylidene-butanoyl)amino]propanoyl]pyrrolidin-2-yl]carbonylamino]-3-methyl-pentanoic acid Openeye Name: 2-[[1-[2-[(2-amino-4-hydroxy-4-oxo-butanoyl)amino]propanoyl]pyrrolidine-2-carbonyl]amino]-3-methyl-pentanoic acid CAS Name: 2-[[[1-[2-[(2-amino-4-hydroxy-1,4-dioxobutyl)amino]-1-oxopropyl]-2-pyrrolidinyl]-oxomethyl]amino]-3-methylpentanoic acid IUPAC Name: 2-[[1-[2-[(2-amino-4-hydroxy-4-oxobutanoyl)amino]propanoyl]pyrrolidine-2-carbonyl]amino]-3-methylpentanoic acid Traditional Name: 2-[[1-[2-[(2-amino-4-hydroxy-4-keto-butanoyl)amino]propanoyl]prolyl]amino]-3-methyl-valeric acid Formula: C18H30N4O7 MolecularWeight: 414.4534

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)O)NC(=O)C1CCCN1C(=O)C(C)NC(=O)C(CC(=O)O)N

Isomeric SMILES

CCC(C)C(C(=O)O)NC(=O)C1CCCN1C(=O)C(C)NC(=O)C(CC(=O)O)N

InChI

InChI=1S/C18H30N4O7/c1-4-9(2)14(18(28)29)21-16(26)12-6-5-7-22(12)17(27)10(3)20-15(25)11(19)8-13(23)24/h9-12,14H,4-8,19H2,1-3H3,(H,20,25)(H,21,26)(H,23,24)(H,28,29)