N-[(1,3-diphenylpyrazol-4-yl)methyl]-1-[(2-nitrophenoxy)methyl]pyrazole-3-carboxamide

Systemtic Name: N-[(1,3-diphenylpyrazol-4-yl)methyl]-1-[(2-nitrophenoxy)methyl]pyrazole-3-carboxamide Openeye Name: N-[(1,3-diphenylpyrazol-4-yl)methyl]-1-[(2-nitrophenoxy)methyl]pyrazole-3-carboxamide CAS Name: N-[(1,3-diphenyl-4-pyrazolyl)methyl]-1-[(2-nitrophenoxy)methyl]-3-pyrazolecarboxamide IUPAC Name: N-[(1,3-diphenylpyrazol-4-yl)methyl]-1-[(2-nitrophenoxy)methyl]pyrazole-3-carboxamide Traditional Name: N-[(1,3-diphenylpyrazol-4-yl)methyl]-1-[(2-nitrophenoxy)methyl]pyrazole-3-carboxamide Formula: C27H22N6O4 MolecularWeight: 494.50138

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN(C=C2CNC(=O)C3=NN(C=C3)COC4=CC=CC=C4[N+](=O)[O-])C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)C2=NN(C=C2CNC(=O)C3=NN(C=C3)COC4=CC=CC=C4[N+](=O)[O-])C5=CC=CC=C5

InChI

InChI=1S/C27H22N6O4/c34-27(23-15-16-31(29-23)19-37-25-14-8-7-13-24(25)33(35)36)28-17-21-18-32(22-11-5-2-6-12-22)30-26(21)20-9-3-1-4-10-20/h1-16,18H,17,19H2,(H,28,34)