N-(4-ethoxy-2-nitro-phenyl)-1-[(4-propan-2-ylphenoxy)methyl]pyrazole-3-carboxamide

Systemtic Name: N-(4-ethoxy-2-nitro-phenyl)-1-[(4-propan-2-ylphenoxy)methyl]pyrazole-3-carboxamide Openeye Name: N-(4-ethoxy-2-nitro-phenyl)-1-[(4-isopropylphenoxy)methyl]pyrazole-3-carboxamide CAS Name: N-(4-ethoxy-2-nitrophenyl)-1-[(4-propan-2-ylphenoxy)methyl]-3-pyrazolecarboxamide IUPAC Name: N-(4-ethoxy-2-nitrophenyl)-1-[(4-propan-2-ylphenoxy)methyl]pyrazole-3-carboxamide Traditional Name: N-(4-ethoxy-2-nitro-phenyl)-1-[(4-isopropylphenoxy)methyl]pyrazole-3-carboxamide Formula: C22H24N4O5 MolecularWeight: 424.44976

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1)NC(=O)C2=NN(C=C2)COC3=CC=C(C=C3)C(C)C)[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC(=C(C=C1)NC(=O)C2=NN(C=C2)COC3=CC=C(C=C3)C(C)C)[N+](=O)[O-]

InChI

InChI=1S/C22H24N4O5/c1-4-30-18-9-10-19(21(13-18)26(28)29)23-22(27)20-11-12-25(24-20)14-31-17-7-5-16(6-8-17)15(2)3/h5-13,15H,4,14H2,1-3H3,(H,23,27)