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

Systemtic Name: 5-azanyl-3-[(Z)-1-cyano-2-[4-(2-cyano-4-nitro-phenoxy)-3-methoxy-phenyl]ethenyl]-1-(2-hydroxyethyl)pyrazole-4-carbonitrile Openeye Name: 5-amino-3-[(Z)-1-cyano-2-[4-(2-cyano-4-nitro-phenoxy)-3-methoxy-phenyl]vinyl]-1-(2-hydroxyethyl)pyrazole-4-carbonitrile CAS Name: 5-amino-3-[(Z)-1-cyano-2-[4-(2-cyano-4-nitrophenoxy)-3-methoxyphenyl]ethenyl]-1-(2-hydroxyethyl)-4-pyrazolecarbonitrile IUPAC Name: 5-amino-3-[(Z)-1-cyano-2-[4-(2-cyano-4-nitrophenoxy)-3-methoxyphenyl]ethenyl]-1-(2-hydroxyethyl)pyrazole-4-carbonitrile Traditional Name: 5-amino-3-[(Z)-1-cyano-2-[4-(2-cyano-4-nitro-phenoxy)-3-methoxy-phenyl]vinyl]-1-(2-hydroxyethyl)pyrazole-4-carbonitrile Formula: C23H17N7O5 MolecularWeight: 471.42498

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=C(C#N)C2=NN(C(=C2C#N)N)CCO)OC3=C(C=C(C=C3)[N+](=O)[O-])C#N

Isomeric SMILES

COC1=C(C=CC(=C1)/C=C(\C#N)/C2=NN(C(=C2C#N)N)CCO)OC3=C(C=C(C=C3)[N+](=O)[O-])C#N

InChI

InChI=1S/C23H17N7O5/c1-34-21-9-14(8-16(12-25)22-18(13-26)23(27)29(28-22)6-7-31)2-4-20(21)35-19-5-3-17(30(32)33)10-15(19)11-24/h2-5,8-10,31H,6-7,27H2,1H3/b16-8+