N-[2-(3,4-dimethoxyphenyl)ethyl]-8-iodanyl-2-phenyl-quinoline-4-carboxamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-8-iodanyl-2-phenyl-quinoline-4-carboxamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-8-iodo-2-phenyl-quinoline-4-carboxamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-8-iodo-2-phenyl-4-quinolinecarboxamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-8-iodo-2-phenylquinoline-4-carboxamide Traditional Name: N-homoveratryl-8-iodo-2-phenyl-cinchoninamide Formula: C26H23IN2O3 MolecularWeight: 538.37689

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=O)C2=CC(=NC3=C2C=CC=C3I)C4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=O)C2=CC(=NC3=C2C=CC=C3I)C4=CC=CC=C4)OC

InChI

InChI=1S/C26H23IN2O3/c1-31-23-12-11-17(15-24(23)32-2)13-14-28-26(30)20-16-22(18-7-4-3-5-8-18)29-25-19(20)9-6-10-21(25)27/h3-12,15-16H,13-14H2,1-2H3,(H,28,30)