ethyl 4-[[3-(4-methoxy-3-nitro-phenyl)-1-phenyl-pyrazol-4-yl]carbonylamino]benzoate

Systemtic Name: ethyl 4-[[3-(4-methoxy-3-nitro-phenyl)-1-phenyl-pyrazol-4-yl]carbonylamino]benzoate Openeye Name: ethyl 4-[[3-(4-methoxy-3-nitro-phenyl)-1-phenyl-pyrazole-4-carbonyl]amino]benzoate CAS Name: 4-[[[3-(4-methoxy-3-nitrophenyl)-1-phenyl-4-pyrazolyl]-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[3-(4-methoxy-3-nitrophenyl)-1-phenylpyrazole-4-carbonyl]amino]benzoate Traditional Name: 4-[[3-(4-methoxy-3-nitro-phenyl)-1-phenyl-pyrazole-4-carbonyl]amino]benzoic acid ethyl ester Formula: C26H22N4O6 MolecularWeight: 486.47608

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)C2=CN(N=C2C3=CC(=C(C=C3)OC)[N+](=O)[O-])C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)C2=CN(N=C2C3=CC(=C(C=C3)OC)[N+](=O)[O-])C4=CC=CC=C4

InChI

InChI=1S/C26H22N4O6/c1-3-36-26(32)17-9-12-19(13-10-17)27-25(31)21-16-29(20-7-5-4-6-8-20)28-24(21)18-11-14-23(35-2)22(15-18)30(33)34/h4-16H,3H2,1-2H3,(H,27,31)