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

Systemtic Name: 2-(aminocarbamoyl)-4-(4-azanyl-5-oxidanyl-5-oxidanylidene-pentanoyl)benzoic acid Openeye Name: 4-(4-amino-5-hydroxy-5-oxo-pentanoyl)-2-(hydrazinecarbonyl)benzoic acid CAS Name: 4-(4-amino-5-hydroxy-1,5-dioxopentyl)-2-(hydrazinecarbonyl)benzoic acid IUPAC Name: 4-(4-amino-5-hydroxy-5-oxopentanoyl)-2-(hydrazinecarbonyl)benzoic acid Traditional Name: 4-(4-amino-5-hydroxy-5-keto-pentanoyl)-2-carbazoyl-benzoic acid Formula: C13H15N3O6 MolecularWeight: 309.2747

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(=O)CCC(C(=O)O)N)C(=O)NN)C(=O)O

Isomeric SMILES

C1=CC(=C(C=C1C(=O)CCC(C(=O)O)N)C(=O)NN)C(=O)O

InChI

InChI=1S/C13H15N3O6/c14-9(13(21)22)3-4-10(17)6-1-2-7(12(19)20)8(5-6)11(18)16-15/h1-2,5,9H,3-4,14-15H2,(H,16,18)(H,19,20)(H,21,22)