(E)-N-[1-hexyl-4-(3-methylbut-2-enoxy)-3-octoxy-2-oxidanylidene-quinolin-7-yl]-3-phenyl-prop-2-enamide

Systemtic Name: (E)-N-[1-hexyl-4-(3-methylbut-2-enoxy)-3-octoxy-2-oxidanylidene-quinolin-7-yl]-3-phenyl-prop-2-enamide Openeye Name: (E)-N-[1-hexyl-4-(3-methylbut-2-enoxy)-3-octoxy-2-oxo-7-quinolyl]-3-phenyl-prop-2-enamide CAS Name: (E)-N-[1-hexyl-4-(3-methylbut-2-enoxy)-3-octoxy-2-oxo-7-quinolinyl]-3-phenyl-2-propenamide IUPAC Name: (E)-N-[1-hexyl-4-(3-methylbut-2-enoxy)-3-octoxy-2-oxoquinolin-7-yl]-3-phenylprop-2-enamide Traditional Name: (E)-N-[1-hexyl-2-keto-4-(3-methylbut-2-enoxy)-3-octoxy-7-quinolyl]-3-phenyl-acrylamide Formula: C37H50N2O4 MolecularWeight: 586.8039

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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)OCC=C(C)C

Isomeric SMILES

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

InChI

InChI=1S/C37H50N2O4/c1-5-7-9-11-12-17-26-42-36-35(43-27-24-29(3)4)32-22-21-31(38-34(40)23-20-30-18-14-13-15-19-30)28-33(32)39(37(36)41)25-16-10-8-6-2/h13-15,18-24,28H,5-12,16-17,25-27H2,1-4H3,(H,38,40)/b23-20+