ethyl 3-[[2-[(2,4-dichlorophenyl)methyl]pyrazol-3-yl]carbamoyl]-5-nitro-benzoate

Systemtic Name: ethyl 3-[[2-[(2,4-dichlorophenyl)methyl]pyrazol-3-yl]carbamoyl]-5-nitro-benzoate Openeye Name: ethyl 3-[[2-[(2,4-dichlorophenyl)methyl]pyrazol-3-yl]carbamoyl]-5-nitro-benzoate CAS Name: 3-[[[2-[(2,4-dichlorophenyl)methyl]-3-pyrazolyl]amino]-oxomethyl]-5-nitrobenzoic acid ethyl ester IUPAC Name: ethyl 3-[[2-[(2,4-dichlorophenyl)methyl]pyrazol-3-yl]carbamoyl]-5-nitrobenzoate Traditional Name: 3-[[2-(2,4-dichlorobenzyl)pyrazol-3-yl]carbamoyl]-5-nitro-benzoic acid ethyl ester Formula: C20H16Cl2N4O5 MolecularWeight: 463.27084

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC(=C1)C(=O)NC2=CC=NN2CC3=C(C=C(C=C3)Cl)Cl)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CC(=CC(=C1)C(=O)NC2=CC=NN2CC3=C(C=C(C=C3)Cl)Cl)[N+](=O)[O-]

InChI

InChI=1S/C20H16Cl2N4O5/c1-2-31-20(28)14-7-13(8-16(9-14)26(29)30)19(27)24-18-5-6-23-25(18)11-12-3-4-15(21)10-17(12)22/h3-10H,2,11H2,1H3,(H,24,27)