(E)-N-(4-butoxy-1-hexyl-3-octoxy-2-oxidanylidene-quinolin-7-yl)-3-phenyl-prop-2-enamide

Systemtic Name: (E)-N-(4-butoxy-1-hexyl-3-octoxy-2-oxidanylidene-quinolin-7-yl)-3-phenyl-prop-2-enamide Openeye Name: (E)-N-(4-butoxy-1-hexyl-3-octoxy-2-oxo-7-quinolyl)-3-phenyl-prop-2-enamide CAS Name: (E)-N-(4-butoxy-1-hexyl-3-octoxy-2-oxo-7-quinolinyl)-3-phenyl-2-propenamide IUPAC Name: (E)-N-(4-butoxy-1-hexyl-3-octoxy-2-oxoquinolin-7-yl)-3-phenylprop-2-enamide Traditional Name: (E)-N-(4-butoxy-1-hexyl-2-keto-3-octoxy-7-quinolyl)-3-phenyl-acrylamide Formula: C36H50N2O4 MolecularWeight: 574.7932

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=C(C2=C(C=C(C=C2)NC(=O)C=CC3=CC=CC=C3)N(C1=O)CCCCCC)OCCCC

Isomeric SMILES

CCCCCCCCOC1=C(C2=C(C=C(C=C2)NC(=O)/C=C/C3=CC=CC=C3)N(C1=O)CCCCCC)OCCCC

InChI

InChI=1S/C36H50N2O4/c1-4-7-10-12-13-18-27-42-35-34(41-26-9-6-3)31-23-22-30(37-33(39)24-21-29-19-15-14-16-20-29)28-32(31)38(36(35)40)25-17-11-8-5-2/h14-16,19-24,28H,4-13,17-18,25-27H2,1-3H3,(H,37,39)/b24-21+