N-[2-(3,4-diethoxyphenyl)ethyl]-2-[(4-propan-2-ylphenyl)amino]quinoline-4-carboxamide

Systemtic Name: N-[2-(3,4-diethoxyphenyl)ethyl]-2-[(4-propan-2-ylphenyl)amino]quinoline-4-carboxamide Openeye Name: N-[2-(3,4-diethoxyphenyl)ethyl]-2-(4-isopropylanilino)quinoline-4-carboxamide CAS Name: N-[2-(3,4-diethoxyphenyl)ethyl]-2-(4-propan-2-ylanilino)-4-quinolinecarboxamide IUPAC Name: N-[2-(3,4-diethoxyphenyl)ethyl]-2-(4-propan-2-ylanilino)quinoline-4-carboxamide Traditional Name: 2-cumidino-N-[2-(3,4-diethoxyphenyl)ethyl]cinchoninamide Formula: C31H35N3O3 MolecularWeight: 497.6279

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CCNC(=O)C2=CC(=NC3=CC=CC=C32)NC4=CC=C(C=C4)C(C)C)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CCNC(=O)C2=CC(=NC3=CC=CC=C32)NC4=CC=C(C=C4)C(C)C)OCC

InChI

InChI=1S/C31H35N3O3/c1-5-36-28-16-11-22(19-29(28)37-6-2)17-18-32-31(35)26-20-30(34-27-10-8-7-9-25(26)27)33-24-14-12-23(13-15-24)21(3)4/h7-16,19-21H,5-6,17-18H2,1-4H3,(H,32,35)(H,33,34)