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

Systemtic Name: (E)-N-(4-butoxy-1-methyl-3-octoxy-2-oxidanylidene-quinolin-7-yl)-3-phenyl-prop-2-enamide Openeye Name: (E)-N-(4-butoxy-1-methyl-3-octoxy-2-oxo-7-quinolyl)-3-phenyl-prop-2-enamide CAS Name: (E)-N-(4-butoxy-1-methyl-3-octoxy-2-oxo-7-quinolinyl)-3-phenyl-2-propenamide IUPAC Name: (E)-N-(4-butoxy-1-methyl-3-octoxy-2-oxoquinolin-7-yl)-3-phenylprop-2-enamide Traditional Name: (E)-N-(4-butoxy-2-keto-1-methyl-3-octoxy-7-quinolyl)-3-phenyl-acrylamide Formula: C31H40N2O4 MolecularWeight: 504.6603

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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)C)OCCCC

Isomeric SMILES

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

InChI

InChI=1S/C31H40N2O4/c1-4-6-8-9-10-14-22-37-30-29(36-21-7-5-2)26-19-18-25(23-27(26)33(3)31(30)35)32-28(34)20-17-24-15-12-11-13-16-24/h11-13,15-20,23H,4-10,14,21-22H2,1-3H3,(H,32,34)/b20-17+