sodium 3-[6-(2H-benzotriazol-5-yliminomethoxy)-3-oxidanyl-3,4-dihydro-2H-quinolin-1-yl]propanoate

Systemtic Name: sodium 3-[6-(2H-benzotriazol-5-yliminomethoxy)-3-oxidanyl-3,4-dihydro-2H-quinolin-1-yl]propanoate Openeye Name: sodium 3-[6-(2H-benzotriazol-5-yliminomethoxy)-3-hydroxy-3,4-dihydro-2H-quinolin-1-yl]propanoate CAS Name: sodium 3-[6-(2H-benzotriazol-5-yliminomethoxy)-3-hydroxy-3,4-dihydro-2H-quinolin-1-yl]propanoate IUPAC Name: sodium 3-[6-(2H-benzotriazol-5-yliminomethoxy)-3-hydroxy-3,4-dihydro-2H-quinolin-1-yl]propanoate Traditional Name: sodium 3-[6-(2H-benzotriazol-5-yliminomethoxy)-3-hydroxy-3,4-dihydro-2H-quinolin-1-yl]propionate Formula: C19H18N5NaO4 MolecularWeight: 403.36709

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(C2=C1C=C(C=C2)OC=NC3=CC4=NNN=C4C=C3)CCC(=O)[O-])O.[Na+]

Isomeric SMILES

C1C(CN(C2=C1C=C(C=C2)OC=NC3=CC4=NNN=C4C=C3)CCC(=O)[O-])O.[Na+]

InChI

InChI=1S/C19H19N5O4.Na/c25-14-7-12-8-15(2-4-18(12)24(10-14)6-5-19(26)27)28-11-20-13-1-3-16-17(9-13)22-23-21-16;/h1-4,8-9,11,14,25H,5-7,10H2,(H,26,27)(H,21,22,23);/q;+1/p-1