2-azanyl-4-[5-(2-azanyl-3-oxidanyl-3-oxidanylidene-propyl)-2-oxidanyl-phenyl]pentanedioic acid

Systemtic Name: 2-azanyl-4-[5-(2-azanyl-3-oxidanyl-3-oxidanylidene-propyl)-2-oxidanyl-phenyl]pentanedioic acid Openeye Name: 2-amino-4-[5-(2-amino-3-hydroxy-3-oxo-propyl)-2-hydroxy-phenyl]pentanedioic acid CAS Name: 2-amino-4-[5-(2-amino-3-hydroxy-3-oxopropyl)-2-hydroxyphenyl]pentanedioic acid IUPAC Name: 2-amino-4-[5-(2-amino-3-hydroxy-3-oxopropyl)-2-hydroxyphenyl]pentanedioic acid Traditional Name: 2-amino-4-[5-(2-amino-3-hydroxy-3-keto-propyl)-2-hydroxy-phenyl]glutaric acid Formula: C14H18N2O7 MolecularWeight: 326.30192

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1CC(C(=O)O)N)C(CC(C(=O)O)N)C(=O)O)O

Isomeric SMILES

C1=CC(=C(C=C1CC(C(=O)O)N)C(CC(C(=O)O)N)C(=O)O)O

InChI

InChI=1S/C14H18N2O7/c15-9(13(20)21)4-6-1-2-11(17)7(3-6)8(12(18)19)5-10(16)14(22)23/h1-3,8-10,17H,4-5,15-16H2,(H,18,19)(H,20,21)(H,22,23)