2-(4-butoxyphenyl)-N-[(E)-1-[4-(pyridin-4-ylcarbonylamino)phenyl]ethylideneamino]quinoline-4-carboxamide

Systemtic Name: 2-(4-butoxyphenyl)-N-[(E)-1-[4-(pyridin-4-ylcarbonylamino)phenyl]ethylideneamino]quinoline-4-carboxamide Openeye Name: 2-(4-butoxyphenyl)-N-[(E)-1-[4-(pyridine-4-carbonylamino)phenyl]ethylideneamino]quinoline-4-carboxamide CAS Name: 2-(4-butoxyphenyl)-N-[(E)-1-[4-[[oxo(pyridin-4-yl)methyl]amino]phenyl]ethylideneamino]-4-quinolinecarboxamide IUPAC Name: 2-(4-butoxyphenyl)-N-[(E)-1-[4-(pyridine-4-carbonylamino)phenyl]ethylideneamino]quinoline-4-carboxamide Traditional Name: 2-(4-butoxyphenyl)-N-[(E)-1-(4-isonicotinamidophenyl)ethylideneamino]cinchoninamide Formula: C34H31N5O3 MolecularWeight: 557.64164

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NN=C(C)C4=CC=C(C=C4)NC(=O)C5=CC=NC=C5

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)N/N=C(\C)/C4=CC=C(C=C4)NC(=O)C5=CC=NC=C5

InChI

InChI=1S/C34H31N5O3/c1-3-4-21-42-28-15-11-25(12-16-28)32-22-30(29-7-5-6-8-31(29)37-32)34(41)39-38-23(2)24-9-13-27(14-10-24)36-33(40)26-17-19-35-20-18-26/h5-20,22H,3-4,21H2,1-2H3,(H,36,40)(H,39,41)/b38-23+