propan-2-yl 1-ethyl-4-[[3-[(3-methyl-4-nitro-phenoxy)methyl]phenyl]carbonylamino]pyrazole-3-carboxylate

Systemtic Name: propan-2-yl 1-ethyl-4-[[3-[(3-methyl-4-nitro-phenoxy)methyl]phenyl]carbonylamino]pyrazole-3-carboxylate Openeye Name: isopropyl 1-ethyl-4-[[3-[(3-methyl-4-nitro-phenoxy)methyl]benzoyl]amino]pyrazole-3-carboxylate CAS Name: 1-ethyl-4-[[[3-[(3-methyl-4-nitrophenoxy)methyl]phenyl]-oxomethyl]amino]-3-pyrazolecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 1-ethyl-4-[[3-[(3-methyl-4-nitrophenoxy)methyl]benzoyl]amino]pyrazole-3-carboxylate Traditional Name: 1-ethyl-4-[[3-[(3-methyl-4-nitro-phenoxy)methyl]benzoyl]amino]pyrazole-3-carboxylic acid isopropyl ester Formula: C24H26N4O6 MolecularWeight: 466.48644

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)C(=O)OC(C)C)NC(=O)C2=CC(=CC=C2)COC3=CC(=C(C=C3)[N+](=O)[O-])C

Isomeric SMILES

CCN1C=C(C(=N1)C(=O)OC(C)C)NC(=O)C2=CC(=CC=C2)COC3=CC(=C(C=C3)[N+](=O)[O-])C

InChI

InChI=1S/C24H26N4O6/c1-5-27-13-20(22(26-27)24(30)34-15(2)3)25-23(29)18-8-6-7-17(12-18)14-33-19-9-10-21(28(31)32)16(4)11-19/h6-13,15H,5,14H2,1-4H3,(H,25,29)