N-[(E)-[3-(5-nitrofuran-2-yl)-1-phenyl-pyrazol-4-yl]methylideneamino]quinolin-3-amine

Systemtic Name: N-[(E)-[3-(5-nitrofuran-2-yl)-1-phenyl-pyrazol-4-yl]methylideneamino]quinolin-3-amine Openeye Name: N-[(E)-[3-(5-nitro-2-furyl)-1-phenyl-pyrazol-4-yl]methyleneamino]quinolin-3-amine CAS Name: N-[(E)-[3-(5-nitro-2-furanyl)-1-phenyl-4-pyrazolyl]methylideneamino]-3-quinolinamine IUPAC Name: N-[(E)-[3-(5-nitrofuran-2-yl)-1-phenylpyrazol-4-yl]methylideneamino]quinolin-3-amine Traditional Name: [(E)-[3-(5-nitro-2-furyl)-1-phenyl-pyrazol-4-yl]methyleneamino]-(3-quinolyl)amine Formula: C23H16N6O3 MolecularWeight: 424.41154

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC=C(O3)[N+](=O)[O-])C=NNC4=CC5=CC=CC=C5N=C4

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC=C(O3)[N+](=O)[O-])/C=N/NC4=CC5=CC=CC=C5N=C4

InChI

InChI=1S/C23H16N6O3/c30-29(31)22-11-10-21(32-22)23-17(15-28(27-23)19-7-2-1-3-8-19)13-25-26-18-12-16-6-4-5-9-20(16)24-14-18/h1-15,26H/b25-13+