N-[(E)-[3-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-4-methoxy-phenyl]methylideneamino]quinoline-3-carboxamide

Systemtic Name: N-[(E)-[3-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-4-methoxy-phenyl]methylideneamino]quinoline-3-carboxamide Openeye Name: N-[(E)-[3-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-4-methoxy-phenyl]methyleneamino]quinoline-3-carboxamide CAS Name: N-[(E)-[3-[(3,5-dimethyl-4-nitro-1-pyrazolyl)methyl]-4-methoxyphenyl]methylideneamino]-3-quinolinecarboxamide IUPAC Name: N-[(E)-[3-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]-4-methoxyphenyl]methylideneamino]quinoline-3-carboxamide Traditional Name: N-[(E)-[3-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-4-methoxy-benzylidene]amino]quinoline-3-carboxamide Formula: C24H22N6O4 MolecularWeight: 458.46928

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=C(C=CC(=C2)C=NNC(=O)C3=CC4=CC=CC=C4N=C3)OC)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CC2=C(C=CC(=C2)/C=N/NC(=O)C3=CC4=CC=CC=C4N=C3)OC)C)[N+](=O)[O-]

InChI

InChI=1S/C24H22N6O4/c1-15-23(30(32)33)16(2)29(28-15)14-20-10-17(8-9-22(20)34-3)12-26-27-24(31)19-11-18-6-4-5-7-21(18)25-13-19/h4-13H,14H2,1-3H3,(H,27,31)/b26-12+