2-(4-butan-2-ylphenyl)-N-[(E)-(3-methoxy-4-propoxy-phenyl)methylideneamino]quinoline-4-carboxamide

Systemtic Name: 2-(4-butan-2-ylphenyl)-N-[(E)-(3-methoxy-4-propoxy-phenyl)methylideneamino]quinoline-4-carboxamide Openeye Name: N-[(E)-(3-methoxy-4-propoxy-phenyl)methyleneamino]-2-(4-sec-butylphenyl)quinoline-4-carboxamide CAS Name: 2-(4-butan-2-ylphenyl)-N-[(E)-(3-methoxy-4-propoxyphenyl)methylideneamino]-4-quinolinecarboxamide IUPAC Name: 2-(4-butan-2-ylphenyl)-N-[(E)-(3-methoxy-4-propoxyphenyl)methylideneamino]quinoline-4-carboxamide Traditional Name: N-[(E)-(3-methoxy-4-propoxy-benzylidene)amino]-2-(4-sec-butylphenyl)cinchoninamide Formula: C31H33N3O3 MolecularWeight: 495.61202

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C=NNC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=C(C=C4)C(C)CC)OC

Isomeric SMILES

CCCOC1=C(C=C(C=C1)/C=N/NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=C(C=C4)C(C)CC)OC

InChI

InChI=1S/C31H33N3O3/c1-5-17-37-29-16-11-22(18-30(29)36-4)20-32-34-31(35)26-19-28(33-27-10-8-7-9-25(26)27)24-14-12-23(13-15-24)21(3)6-2/h7-16,18-21H,5-6,17H2,1-4H3,(H,34,35)/b32-20+