(E)-N-(2-methylquinolin-5-yl)-3-(4-morpholin-4-yl-3-nitro-phenyl)prop-2-enamide

Systemtic Name: (E)-N-(2-methylquinolin-5-yl)-3-(4-morpholin-4-yl-3-nitro-phenyl)prop-2-enamide Openeye Name: (E)-N-(2-methyl-5-quinolyl)-3-(4-morpholino-3-nitro-phenyl)prop-2-enamide CAS Name: (E)-N-(2-methyl-5-quinolinyl)-3-[4-(4-morpholinyl)-3-nitrophenyl]-2-propenamide IUPAC Name: (E)-N-(2-methylquinolin-5-yl)-3-(4-morpholin-4-yl-3-nitrophenyl)prop-2-enamide Traditional Name: (E)-N-(2-methyl-5-quinolyl)-3-(4-morpholino-3-nitro-phenyl)acrylamide Formula: C23H22N4O4 MolecularWeight: 418.44518

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C1)C(=CC=C2)NC(=O)C=CC3=CC(=C(C=C3)N4CCOCC4)[N+](=O)[O-]

Isomeric SMILES

CC1=NC2=C(C=C1)C(=CC=C2)NC(=O)/C=C/C3=CC(=C(C=C3)N4CCOCC4)[N+](=O)[O-]

InChI

InChI=1S/C23H22N4O4/c1-16-5-8-18-19(24-16)3-2-4-20(18)25-23(28)10-7-17-6-9-21(22(15-17)27(29)30)26-11-13-31-14-12-26/h2-10,15H,11-14H2,1H3,(H,25,28)/b10-7+