3,6,8-trimethyl-N-(3-nitrophenyl)-2-(4-phenylmethoxyphenyl)quinoline-4-carboxamide

Systemtic Name: 3,6,8-trimethyl-N-(3-nitrophenyl)-2-(4-phenylmethoxyphenyl)quinoline-4-carboxamide Openeye Name: 2-(4-benzyloxyphenyl)-3,6,8-trimethyl-N-(3-nitrophenyl)quinoline-4-carboxamide CAS Name: 3,6,8-trimethyl-N-(3-nitrophenyl)-2-(4-phenylmethoxyphenyl)-4-quinolinecarboxamide IUPAC Name: 3,6,8-trimethyl-N-(3-nitrophenyl)-2-(4-phenylmethoxyphenyl)quinoline-4-carboxamide Traditional Name: 2-(4-benzoxyphenyl)-3,6,8-trimethyl-N-(3-nitrophenyl)cinchoninamide Formula: C32H27N3O4 MolecularWeight: 517.57448

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)C(=C(C(=N2)C3=CC=C(C=C3)OCC4=CC=CC=C4)C)C(=O)NC5=CC(=CC=C5)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=C2C(=C1)C(=C(C(=N2)C3=CC=C(C=C3)OCC4=CC=CC=C4)C)C(=O)NC5=CC(=CC=C5)[N+](=O)[O-])C

InChI

InChI=1S/C32H27N3O4/c1-20-16-21(2)30-28(17-20)29(32(36)33-25-10-7-11-26(18-25)35(37)38)22(3)31(34-30)24-12-14-27(15-13-24)39-19-23-8-5-4-6-9-23/h4-18H,19H2,1-3H3,(H,33,36)