N-[2-(3,4-dimethoxyphenyl)ethyl]-6-nitro-2-phenyl-quinoline-4-carboxamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-6-nitro-2-phenyl-quinoline-4-carboxamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-6-nitro-2-phenyl-quinoline-4-carboxamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-6-nitro-2-phenyl-4-quinolinecarboxamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-6-nitro-2-phenylquinoline-4-carboxamide Traditional Name: N-homoveratryl-6-nitro-2-phenyl-cinchoninamide Formula: C26H23N3O5 MolecularWeight: 457.47792

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=O)C2=CC(=NC3=C2C=C(C=C3)[N+](=O)[O-])C4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=O)C2=CC(=NC3=C2C=C(C=C3)[N+](=O)[O-])C4=CC=CC=C4)OC

InChI

InChI=1S/C26H23N3O5/c1-33-24-11-8-17(14-25(24)34-2)12-13-27-26(30)21-16-23(18-6-4-3-5-7-18)28-22-10-9-19(29(31)32)15-20(21)22/h3-11,14-16H,12-13H2,1-2H3,(H,27,30)