4-azanyl-2-(2-azanyl-5-oxidanyl-5-oxidanylidene-pentanoyl)benzoic acid

Systemtic Name: 4-azanyl-2-(2-azanyl-5-oxidanyl-5-oxidanylidene-pentanoyl)benzoic acid Openeye Name: 4-amino-2-(2-amino-5-hydroxy-5-oxo-pentanoyl)benzoic acid CAS Name: 4-amino-2-(2-amino-5-hydroxy-1,5-dioxopentyl)benzoic acid IUPAC Name: 4-amino-2-(2-amino-5-hydroxy-5-oxopentanoyl)benzoic acid Traditional Name: 4-amino-2-(2-amino-5-hydroxy-5-keto-pentanoyl)benzoic acid Formula: C12H14N2O5 MolecularWeight: 266.24996

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1N)C(=O)C(CCC(=O)O)N)C(=O)O

Isomeric SMILES

C1=CC(=C(C=C1N)C(=O)C(CCC(=O)O)N)C(=O)O

InChI

InChI=1S/C12H14N2O5/c13-6-1-2-7(12(18)19)8(5-6)11(17)9(14)3-4-10(15)16/h1-2,5,9H,3-4,13-14H2,(H,15,16)(H,18,19)