(E)-azanyl-(6-methoxy-2-phenyl-quinolin-4-yl)-[(5-nitrofuran-2-yl)methylidene]azanium

Systemtic Name: (E)-azanyl-(6-methoxy-2-phenyl-quinolin-4-yl)-[(5-nitrofuran-2-yl)methylidene]azanium Openeye Name: (E)-amino-(6-methoxy-2-phenyl-4-quinolyl)-[(5-nitro-2-furyl)methylene]ammonium CAS Name: (E)-amino-(6-methoxy-2-phenyl-4-quinolinyl)-[(5-nitro-2-furanyl)methylidene]ammonium IUPAC Name: (E)-amino-(6-methoxy-2-phenylquinolin-4-yl)-[(5-nitrofuran-2-yl)methylidene]azanium Traditional Name: (E)-amino-(6-methoxy-2-phenyl-4-quinolyl)-[(5-nitro-2-furyl)methylene]ammonium Formula: C21H17N4O4+ MolecularWeight: 389.38408

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N=C(C=C2[N+](=CC3=CC=C(O3)[N+](=O)[O-])N)C4=CC=CC=C4

Isomeric SMILES

COC1=CC2=C(C=C1)N=C(C=C2/[N+](=C\C3=CC=C(O3)[N+](=O)[O-])/N)C4=CC=CC=C4

InChI

InChI=1S/C21H17N4O4/c1-28-15-7-9-18-17(11-15)20(12-19(23-18)14-5-3-2-4-6-14)24(22)13-16-8-10-21(29-16)25(26)27/h2-13H,22H2,1H3/q+1/b24-13+