N-(2-dimethylaminoethyl)-5-(4-methoxyphenyl)-2-(4-nitrophenyl)pyrazole-3-carboxamide

Systemtic Name: N-(2-dimethylaminoethyl)-5-(4-methoxyphenyl)-2-(4-nitrophenyl)pyrazole-3-carboxamide Openeye Name: N-(2-dimethylaminoethyl)-5-(4-methoxyphenyl)-2-(4-nitrophenyl)pyrazole-3-carboxamide CAS Name: N-(2-dimethylaminoethyl)-5-(4-methoxyphenyl)-2-(4-nitrophenyl)-3-pyrazolecarboxamide IUPAC Name: N-(2-dimethylaminoethyl)-5-(4-methoxyphenyl)-2-(4-nitrophenyl)pyrazole-3-carboxamide Traditional Name: N-(2-dimethylaminoethyl)-5-(4-methoxyphenyl)-2-(4-nitrophenyl)pyrazole-3-carboxamide Formula: C21H23N5O4 MolecularWeight: 409.43842

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCNC(=O)C1=CC(=NN1C2=CC=C(C=C2)[N+](=O)[O-])C3=CC=C(C=C3)OC

Isomeric SMILES

CN(C)CCNC(=O)C1=CC(=NN1C2=CC=C(C=C2)[N+](=O)[O-])C3=CC=C(C=C3)OC

InChI

InChI=1S/C21H23N5O4/c1-24(2)13-12-22-21(27)20-14-19(15-4-10-18(30-3)11-5-15)23-25(20)16-6-8-17(9-7-16)26(28)29/h4-11,14H,12-13H2,1-3H3,(H,22,27)