N-[2-(hydroxymethyl)-1,3-bis(oxidanyl)propan-2-yl]-2-(4-methoxyphenyl)quinoline-4-carboxamide

Systemtic Name: N-[2-(hydroxymethyl)-1,3-bis(oxidanyl)propan-2-yl]-2-(4-methoxyphenyl)quinoline-4-carboxamide Openeye Name: N-[2-hydroxy-1,1-bis(hydroxymethyl)ethyl]-2-(4-methoxyphenyl)quinoline-4-carboxamide CAS Name: N-[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]-2-(4-methoxyphenyl)-4-quinolinecarboxamide IUPAC Name: N-[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]-2-(4-methoxyphenyl)quinoline-4-carboxamide Traditional Name: N-(2-hydroxy-1,1-dimethylol-ethyl)-2-(4-methoxyphenyl)cinchoninamide Formula: C21H22N2O5 MolecularWeight: 382.40978

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC(CO)(CO)CO

Isomeric SMILES

COC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC(CO)(CO)CO

InChI

InChI=1S/C21H22N2O5/c1-28-15-8-6-14(7-9-15)19-10-17(16-4-2-3-5-18(16)22-19)20(27)23-21(11-24,12-25)13-26/h2-10,24-26H,11-13H2,1H3,(H,23,27)