4-[[4-[2,3-bis(oxidanyl)propoxy]phenyl]amino]-6-ethoxy-1,5-naphthyridine-3-carboxylate

Systemtic Name: 4-[[4-[2,3-bis(oxidanyl)propoxy]phenyl]amino]-6-ethoxy-1,5-naphthyridine-3-carboxylate Openeye Name: 4-[4-(2,3-dihydroxypropoxy)anilino]-6-ethoxy-1,5-naphthyridine-3-carboxylate CAS Name: 4-[4-(2,3-dihydroxypropoxy)anilino]-6-ethoxy-1,5-naphthyridine-3-carboxylate IUPAC Name: 4-[4-(2,3-dihydroxypropoxy)anilino]-6-ethoxy-1,5-naphthyridine-3-carboxylate Traditional Name: 6-ethoxy-4-(4-glyceryloxyanilino)-1,5-naphthyridine-3-carboxylate Formula: C20H20N3O6- MolecularWeight: 398.3893

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=NC2=C(C(=CN=C2C=C1)C(=O)[O-])NC3=CC=C(C=C3)OCC(CO)O

Isomeric SMILES

CCOC1=NC2=C(C(=CN=C2C=C1)C(=O)[O-])NC3=CC=C(C=C3)OCC(CO)O

InChI

InChI=1S/C20H21N3O6/c1-2-28-17-8-7-16-19(23-17)18(15(9-21-16)20(26)27)22-12-3-5-14(6-4-12)29-11-13(25)10-24/h3-9,13,24-25H,2,10-11H2,1H3,(H,21,22)(H,26,27)/p-1