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

Systemtic Name: 5-azanyl-3-[(Z)-2-(2-chloranyl-5-nitro-phenyl)-1-cyano-ethenyl]-1-(2-hydroxyethyl)pyrazole-4-carbonitrile Openeye Name: 5-amino-3-[(Z)-2-(2-chloro-5-nitro-phenyl)-1-cyano-vinyl]-1-(2-hydroxyethyl)pyrazole-4-carbonitrile CAS Name: 5-amino-3-[(Z)-2-(2-chloro-5-nitrophenyl)-1-cyanoethenyl]-1-(2-hydroxyethyl)-4-pyrazolecarbonitrile IUPAC Name: 5-amino-3-[(Z)-2-(2-chloro-5-nitrophenyl)-1-cyanoethenyl]-1-(2-hydroxyethyl)pyrazole-4-carbonitrile Traditional Name: 5-amino-3-[(Z)-2-(2-chloro-5-nitro-phenyl)-1-cyano-vinyl]-1-(2-hydroxyethyl)pyrazole-4-carbonitrile Formula: C15H11ClN6O3 MolecularWeight: 358.73924

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H11ClN6O3/c16-13-2-1-11(22(24)25)6-9(13)5-10(7-17)14-12(8-18)15(19)21(20-14)3-4-23/h1-2,5-6,23H,3-4,19H2/b10-5+