sodium 2-[4-(7-bromanylquinoxalin-2-yl)oxyphenoxy]propanoate

Systemtic Name: sodium 2-[4-(7-bromanylquinoxalin-2-yl)oxyphenoxy]propanoate Openeye Name: sodium 2-[4-(7-bromoquinoxalin-2-yl)oxyphenoxy]propanoate CAS Name: sodium 2-[4-[(7-bromo-2-quinoxalinyl)oxy]phenoxy]propanoate IUPAC Name: sodium 2-[4-(7-bromoquinoxalin-2-yl)oxyphenoxy]propanoate Traditional Name: sodium 2-[4-(7-bromoquinoxalin-2-yl)oxyphenoxy]propionate Formula: C17H12BrN2NaO4 MolecularWeight: 411.18195

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)[O-])OC1=CC=C(C=C1)OC2=CN=C3C=CC(=CC3=N2)Br.[Na+]

Isomeric SMILES

CC(C(=O)[O-])OC1=CC=C(C=C1)OC2=CN=C3C=CC(=CC3=N2)Br.[Na+]

InChI

InChI=1S/C17H13BrN2O4.Na/c1-10(17(21)22)23-12-3-5-13(6-4-12)24-16-9-19-14-7-2-11(18)8-15(14)20-16;/h2-10H,1H3,(H,21,22);/q;+1/p-1