N-[2-[3,4-bis(oxidanyl)phenyl]ethyl]-2-naphthalen-1-yl-quinoline-4-carboxamide

Systemtic Name: N-[2-[3,4-bis(oxidanyl)phenyl]ethyl]-2-naphthalen-1-yl-quinoline-4-carboxamide Openeye Name: N-[2-(3,4-dihydroxyphenyl)ethyl]-2-(1-naphthyl)quinoline-4-carboxamide CAS Name: N-[2-(3,4-dihydroxyphenyl)ethyl]-2-(1-naphthalenyl)-4-quinolinecarboxamide IUPAC Name: N-[2-(3,4-dihydroxyphenyl)ethyl]-2-naphthalen-1-ylquinoline-4-carboxamide Traditional Name: N-[2-(3,4-dihydroxyphenyl)ethyl]-2-(1-naphthyl)cinchoninamide Formula: C28H22N2O3 MolecularWeight: 434.48588

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2C3=NC4=CC=CC=C4C(=C3)C(=O)NCCC5=CC(=C(C=C5)O)O

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2C3=NC4=CC=CC=C4C(=C3)C(=O)NCCC5=CC(=C(C=C5)O)O

InChI

InChI=1S/C28H22N2O3/c31-26-13-12-18(16-27(26)32)14-15-29-28(33)23-17-25(30-24-11-4-3-9-22(23)24)21-10-5-7-19-6-1-2-8-20(19)21/h1-13,16-17,31-32H,14-15H2,(H,29,33)