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

Systemtic Name: 5-azanyl-3-[(Z)-1-cyano-2-[2-(dimethylamino)-5-nitro-phenyl]ethenyl]-1-phenyl-pyrazole-4-carbonitrile Openeye Name: 5-amino-3-[(Z)-1-cyano-2-[2-(dimethylamino)-5-nitro-phenyl]vinyl]-1-phenyl-pyrazole-4-carbonitrile CAS Name: 5-amino-3-[(Z)-1-cyano-2-[2-(dimethylamino)-5-nitrophenyl]ethenyl]-1-phenyl-4-pyrazolecarbonitrile IUPAC Name: 5-amino-3-[(Z)-1-cyano-2-[2-(dimethylamino)-5-nitrophenyl]ethenyl]-1-phenylpyrazole-4-carbonitrile Traditional Name: 5-amino-3-[(Z)-1-cyano-2-[2-(dimethylamino)-5-nitro-phenyl]vinyl]-1-phenyl-pyrazole-4-carbonitrile Formula: C21H17N7O2 MolecularWeight: 399.40538

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H17N7O2/c1-26(2)19-9-8-17(28(29)30)11-14(19)10-15(12-22)20-18(13-23)21(24)27(25-20)16-6-4-3-5-7-16/h3-11H,24H2,1-2H3/b15-10+