N-[(E)-(4-chloranyl-3-nitro-phenyl)methylideneamino]-3-(3,4-dimethoxyphenyl)-1H-pyrazole-5-carboxamide

Systemtic Name: N-[(E)-(4-chloranyl-3-nitro-phenyl)methylideneamino]-3-(3,4-dimethoxyphenyl)-1H-pyrazole-5-carboxamide Openeye Name: N-[(E)-(4-chloro-3-nitro-phenyl)methyleneamino]-3-(3,4-dimethoxyphenyl)-1H-pyrazole-5-carboxamide CAS Name: N-[(E)-(4-chloro-3-nitrophenyl)methylideneamino]-3-(3,4-dimethoxyphenyl)-1H-pyrazole-5-carboxamide IUPAC Name: N-[(E)-(4-chloro-3-nitrophenyl)methylideneamino]-3-(3,4-dimethoxyphenyl)-1H-pyrazole-5-carboxamide Traditional Name: N-[(E)-(4-chloro-3-nitro-benzylidene)amino]-3-(3,4-dimethoxyphenyl)-1H-pyrazole-5-carboxamide Formula: C19H16ClN5O5 MolecularWeight: 429.81384

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NNC(=C2)C(=O)NN=CC3=CC(=C(C=C3)Cl)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NNC(=C2)C(=O)N/N=C/C3=CC(=C(C=C3)Cl)[N+](=O)[O-])OC

InChI

InChI=1S/C19H16ClN5O5/c1-29-17-6-4-12(8-18(17)30-2)14-9-15(23-22-14)19(26)24-21-10-11-3-5-13(20)16(7-11)25(27)28/h3-10H,1-2H3,(H,22,23)(H,24,26)/b21-10+