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

Systemtic Name: N-[(E)-[3-[(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)methyl]-4-methoxy-phenyl]methylideneamino]-4-nitro-aniline Openeye Name: N-[(E)-[3-[(4-bromo-3,5-dimethyl-pyrazol-1-yl)methyl]-4-methoxy-phenyl]methyleneamino]-4-nitro-aniline CAS Name: N-[(E)-[3-[(4-bromo-3,5-dimethyl-1-pyrazolyl)methyl]-4-methoxyphenyl]methylideneamino]-4-nitroaniline IUPAC Name: N-[(E)-[3-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]-4-methoxyphenyl]methylideneamino]-4-nitroaniline Traditional Name: [(E)-[3-[(4-bromo-3,5-dimethyl-pyrazol-1-yl)methyl]-4-methoxy-benzylidene]amino]-(4-nitrophenyl)amine Formula: C20H20BrN5O3 MolecularWeight: 458.3085

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=C(C=CC(=C2)C=NNC3=CC=C(C=C3)[N+](=O)[O-])OC)C)Br

Isomeric SMILES

CC1=C(C(=NN1CC2=C(C=CC(=C2)/C=N/NC3=CC=C(C=C3)[N+](=O)[O-])OC)C)Br

InChI

InChI=1S/C20H20BrN5O3/c1-13-20(21)14(2)25(24-13)12-16-10-15(4-9-19(16)29-3)11-22-23-17-5-7-18(8-6-17)26(27)28/h4-11,23H,12H2,1-3H3/b22-11+