N-[5-(diethylamino)pentan-2-yl]-2-[(E)-2-(5-nitrofuran-2-yl)ethenyl]quinoline-4-carboxamide

Systemtic Name: N-[5-(diethylamino)pentan-2-yl]-2-[(E)-2-(5-nitrofuran-2-yl)ethenyl]quinoline-4-carboxamide Openeye Name: N-[4-(diethylamino)-1-methyl-butyl]-2-[(E)-2-(5-nitro-2-furyl)vinyl]quinoline-4-carboxamide CAS Name: N-[5-(diethylamino)pentan-2-yl]-2-[(E)-2-(5-nitro-2-furanyl)ethenyl]-4-quinolinecarboxamide IUPAC Name: N-[5-(diethylamino)pentan-2-yl]-2-[(E)-2-(5-nitrofuran-2-yl)ethenyl]quinoline-4-carboxamide Traditional Name: N-[4-(diethylamino)-1-methyl-butyl]-2-[(E)-2-(5-nitro-2-furyl)vinyl]cinchoninamide Formula: C25H30N4O4 MolecularWeight: 450.5301

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCCC(C)NC(=O)C1=CC(=NC2=CC=CC=C21)C=CC3=CC=C(O3)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)CCCC(C)NC(=O)C1=CC(=NC2=CC=CC=C21)/C=C/C3=CC=C(O3)[N+](=O)[O-]

InChI

InChI=1S/C25H30N4O4/c1-4-28(5-2)16-8-9-18(3)26-25(30)22-17-19(27-23-11-7-6-10-21(22)23)12-13-20-14-15-24(33-20)29(31)32/h6-7,10-15,17-18H,4-5,8-9,16H2,1-3H3,(H,26,30)/b13-12+