2-[[2-(aminocarbonylamino)-3-methyl-pentanoyl]amino]-5-azanyl-5-oxidanylidene-pentanoic acid

Systemtic Name: 2-[[2-(aminocarbonylamino)-3-methyl-pentanoyl]amino]-5-azanyl-5-oxidanylidene-pentanoic acid Openeye Name: 5-amino-2-[(3-methyl-2-ureido-pentanoyl)amino]-5-oxo-pentanoic acid CAS Name: 5-amino-2-[[2-(carbamoylamino)-3-methyl-1-oxopentyl]amino]-5-oxopentanoic acid IUPAC Name: 5-amino-2-[[2-(carbamoylamino)-3-methylpentanoyl]amino]-5-oxopentanoic acid Traditional Name: 5-amino-5-keto-2-[(3-methyl-2-ureido-pentanoyl)amino]valeric acid Formula: C12H22N4O5 MolecularWeight: 302.32688

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H22N4O5/c1-3-6(2)9(16-12(14)21)10(18)15-7(11(19)20)4-5-8(13)17/h6-7,9H,3-5H2,1-2H3,(H2,13,17)(H,15,18)(H,19,20)(H3,14,16,21)