5-azanyl-3-[(Z)-1-cyano-2-[4-(2-cyano-4-nitro-phenoxy)-3-methoxy-phenyl]ethenyl]-1-phenyl-pyrazole-4-carbonitrile

Systemtic Name: 5-azanyl-3-[(Z)-1-cyano-2-[4-(2-cyano-4-nitro-phenoxy)-3-methoxy-phenyl]ethenyl]-1-phenyl-pyrazole-4-carbonitrile Openeye Name: 5-amino-3-[(Z)-1-cyano-2-[4-(2-cyano-4-nitro-phenoxy)-3-methoxy-phenyl]vinyl]-1-phenyl-pyrazole-4-carbonitrile CAS Name: 5-amino-3-[(Z)-1-cyano-2-[4-(2-cyano-4-nitrophenoxy)-3-methoxyphenyl]ethenyl]-1-phenyl-4-pyrazolecarbonitrile IUPAC Name: 5-amino-3-[(Z)-1-cyano-2-[4-(2-cyano-4-nitrophenoxy)-3-methoxyphenyl]ethenyl]-1-phenylpyrazole-4-carbonitrile Traditional Name: 5-amino-3-[(Z)-1-cyano-2-[4-(2-cyano-4-nitro-phenoxy)-3-methoxy-phenyl]vinyl]-1-phenyl-pyrazole-4-carbonitrile Formula: C27H17N7O4 MolecularWeight: 503.46838

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=C(C#N)C2=NN(C(=C2C#N)N)C3=CC=CC=C3)OC4=C(C=C(C=C4)[N+](=O)[O-])C#N

Isomeric SMILES

COC1=C(C=CC(=C1)/C=C(\C#N)/C2=NN(C(=C2C#N)N)C3=CC=CC=C3)OC4=C(C=C(C=C4)[N+](=O)[O-])C#N

InChI

InChI=1S/C27H17N7O4/c1-37-25-12-17(7-9-24(25)38-23-10-8-21(34(35)36)13-18(23)14-28)11-19(15-29)26-22(16-30)27(31)33(32-26)20-5-3-2-4-6-20/h2-13H,31H2,1H3/b19-11+