5-azanyl-2-[2-[(2-azanyl-4-oxidanyl-4-oxidanylidene-butanoyl)amino]ethanoyl]-2-formamido-3-oxidanyl-4-oxidanylidene-heptanedioic acid

Systemtic Name: 5-azanyl-2-[2-[(2-azanyl-4-oxidanyl-4-oxidanylidene-butanoyl)amino]ethanoyl]-2-formamido-3-oxidanyl-4-oxidanylidene-heptanedioic acid Openeye Name: 5-amino-2-[2-[(2-amino-4-hydroxy-4-oxo-butanoyl)amino]acetyl]-2-formamido-3-hydroxy-4-oxo-heptanedioic acid CAS Name: 5-amino-2-[2-[(2-amino-4-hydroxy-1,4-dioxobutyl)amino]-1-oxoethyl]-2-formamido-3-hydroxy-4-oxoheptanedioic acid IUPAC Name: 5-amino-2-[2-[(2-amino-4-hydroxy-4-oxobutanoyl)amino]acetyl]-2-formamido-3-hydroxy-4-oxoheptanedioic acid Traditional Name: 5-amino-2-[2-[(2-amino-4-hydroxy-4-keto-butanoyl)amino]acetyl]-2-formamido-3-hydroxy-4-keto-pimelic acid Formula: C14H20N4O11 MolecularWeight: 420.3288

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H20N4O11/c15-5(1-8(21)22)10(25)11(26)14(13(28)29,18-4-19)7(20)3-17-12(27)6(16)2-9(23)24/h4-6,11,26H,1-3,15-16H2,(H,17,27)(H,18,19)(H,21,22)(H,23,24)(H,28,29)