2-[[4-azanyl-2-[2,6-bis(azanyl)hexanoylamino]-4-oxidanylidene-butanoyl]amino]-3-methyl-butanoic acid

Systemtic Name: 2-[[4-azanyl-2-[2,6-bis(azanyl)hexanoylamino]-4-oxidanylidene-butanoyl]amino]-3-methyl-butanoic acid Openeye Name: 2-[[4-amino-2-(2,6-diaminohexanoylamino)-4-oxo-butanoyl]amino]-3-methyl-butanoic acid CAS Name: 2-[[4-amino-2-[(2,6-diamino-1-oxohexyl)amino]-1,4-dioxobutyl]amino]-3-methylbutanoic acid IUPAC Name: 2-[[4-amino-2-(2,6-diaminohexanoylamino)-4-oxobutanoyl]amino]-3-methylbutanoic acid Traditional Name: 2-[[4-amino-2-(2,6-diaminohexanoylamino)-4-keto-butanoyl]amino]-3-methyl-butyric acid Formula: C15H29N5O5 MolecularWeight: 359.42126

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)NC(=O)C(CC(=O)N)NC(=O)C(CCCCN)N

Isomeric SMILES

CC(C)C(C(=O)O)NC(=O)C(CC(=O)N)NC(=O)C(CCCCN)N

InChI

InChI=1S/C15H29N5O5/c1-8(2)12(15(24)25)20-14(23)10(7-11(18)21)19-13(22)9(17)5-3-4-6-16/h8-10,12H,3-7,16-17H2,1-2H3,(H2,18,21)(H,19,22)(H,20,23)(H,24,25)