1-[(4-tert-butylphenoxy)methyl]-N-[3-(4-chloranyl-3-methyl-phenoxy)-5-nitro-phenyl]pyrazole-3-carboxamide

Systemtic Name: 1-[(4-tert-butylphenoxy)methyl]-N-[3-(4-chloranyl-3-methyl-phenoxy)-5-nitro-phenyl]pyrazole-3-carboxamide Openeye Name: 1-[(4-tert-butylphenoxy)methyl]-N-[3-(4-chloro-3-methyl-phenoxy)-5-nitro-phenyl]pyrazole-3-carboxamide CAS Name: 1-[(4-tert-butylphenoxy)methyl]-N-[3-(4-chloro-3-methylphenoxy)-5-nitrophenyl]-3-pyrazolecarboxamide IUPAC Name: 1-[(4-tert-butylphenoxy)methyl]-N-[3-(4-chloro-3-methylphenoxy)-5-nitrophenyl]pyrazole-3-carboxamide Traditional Name: 1-[(4-tert-butylphenoxy)methyl]-N-[3-(4-chloro-3-methyl-phenoxy)-5-nitro-phenyl]pyrazole-3-carboxamide Formula: C28H27ClN4O5 MolecularWeight: 534.99078

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OC2=CC(=CC(=C2)[N+](=O)[O-])NC(=O)C3=NN(C=C3)COC4=CC=C(C=C4)C(C)(C)C)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)OC2=CC(=CC(=C2)[N+](=O)[O-])NC(=O)C3=NN(C=C3)COC4=CC=C(C=C4)C(C)(C)C)Cl

InChI

InChI=1S/C28H27ClN4O5/c1-18-13-23(9-10-25(18)29)38-24-15-20(14-21(16-24)33(35)36)30-27(34)26-11-12-32(31-26)17-37-22-7-5-19(6-8-22)28(2,3)4/h5-16H,17H2,1-4H3,(H,30,34)