2-azanyl-3-[4-[4-(2-azanyl-3-oxidanyl-3-oxidanylidene-propyl)phenyl]peroxyphenyl]propanoic acid

Systemtic Name: 2-azanyl-3-[4-[4-(2-azanyl-3-oxidanyl-3-oxidanylidene-propyl)phenyl]peroxyphenyl]propanoic acid Openeye Name: 2-amino-3-[4-[4-(2-amino-3-hydroxy-3-oxo-propyl)phenyl]peroxyphenyl]propanoic acid CAS Name: 2-amino-3-[4-[4-(2-amino-3-hydroxy-3-oxopropyl)phenyl]dioxyphenyl]propanoic acid IUPAC Name: 2-amino-3-[4-[4-(2-amino-3-hydroxy-3-oxopropyl)phenyl]peroxyphenyl]propanoic acid Traditional Name: 2-amino-3-[4-[4-(2-amino-3-hydroxy-3-keto-propyl)phenyl]peroxyphenyl]propionic acid Formula: C18H20N2O6 MolecularWeight: 360.3612

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC(C(=O)O)N)OOC2=CC=C(C=C2)CC(C(=O)O)N

Isomeric SMILES

C1=CC(=CC=C1CC(C(=O)O)N)OOC2=CC=C(C=C2)CC(C(=O)O)N

InChI

InChI=1S/C18H20N2O6/c19-15(17(21)22)9-11-1-5-13(6-2-11)25-26-14-7-3-12(4-8-14)10-16(20)18(23)24/h1-8,15-16H,9-10,19-20H2,(H,21,22)(H,23,24)