N-[(E)-(4-butoxyphenyl)methylideneamino]-2-(4-ethoxyphenyl)quinoline-4-carboxamide

Systemtic Name: N-[(E)-(4-butoxyphenyl)methylideneamino]-2-(4-ethoxyphenyl)quinoline-4-carboxamide Openeye Name: N-[(E)-(4-butoxyphenyl)methyleneamino]-2-(4-ethoxyphenyl)quinoline-4-carboxamide CAS Name: N-[(E)-(4-butoxyphenyl)methylideneamino]-2-(4-ethoxyphenyl)-4-quinolinecarboxamide IUPAC Name: N-[(E)-(4-butoxyphenyl)methylideneamino]-2-(4-ethoxyphenyl)quinoline-4-carboxamide Traditional Name: N-[(E)-(4-butoxybenzylidene)amino]-2-p-phenetyl-cinchoninamide Formula: C29H29N3O3 MolecularWeight: 467.55886

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C=NNC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=C(C=C4)OCC

Isomeric SMILES

CCCCOC1=CC=C(C=C1)/C=N/NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=C(C=C4)OCC

InChI

InChI=1S/C29H29N3O3/c1-3-5-18-35-24-14-10-21(11-15-24)20-30-32-29(33)26-19-28(31-27-9-7-6-8-25(26)27)22-12-16-23(17-13-22)34-4-2/h6-17,19-20H,3-5,18H2,1-2H3,(H,32,33)/b30-20+