N-[(E)-[4-methoxy-3-[(4-nitropyrazol-1-yl)methyl]phenyl]methylideneamino]-4-nitro-aniline

Systemtic Name: N-[(E)-[4-methoxy-3-[(4-nitropyrazol-1-yl)methyl]phenyl]methylideneamino]-4-nitro-aniline Openeye Name: N-[(E)-[4-methoxy-3-[(4-nitropyrazol-1-yl)methyl]phenyl]methyleneamino]-4-nitro-aniline CAS Name: N-[(E)-[4-methoxy-3-[(4-nitro-1-pyrazolyl)methyl]phenyl]methylideneamino]-4-nitroaniline IUPAC Name: N-[(E)-[4-methoxy-3-[(4-nitropyrazol-1-yl)methyl]phenyl]methylideneamino]-4-nitroaniline Traditional Name: [(E)-[4-methoxy-3-[(4-nitropyrazol-1-yl)methyl]benzylidene]amino]-(4-nitrophenyl)amine Formula: C18H16N6O5 MolecularWeight: 396.35684

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=NNC2=CC=C(C=C2)[N+](=O)[O-])CN3C=C(C=N3)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)/C=N/NC2=CC=C(C=C2)[N+](=O)[O-])CN3C=C(C=N3)[N+](=O)[O-]

InChI

InChI=1S/C18H16N6O5/c1-29-18-7-2-13(8-14(18)11-22-12-17(10-20-22)24(27)28)9-19-21-15-3-5-16(6-4-15)23(25)26/h2-10,12,21H,11H2,1H3/b19-9+