ethyl 5-(4-chlorophenyl)-4-methyl-2-[(4-nitrophenyl)carbamoyl]-3H-pyrazole-4-carboxylate

Systemtic Name: ethyl 5-(4-chlorophenyl)-4-methyl-2-[(4-nitrophenyl)carbamoyl]-3H-pyrazole-4-carboxylate Openeye Name: ethyl 5-(4-chlorophenyl)-4-methyl-2-[(4-nitrophenyl)carbamoyl]-3H-pyrazole-4-carboxylate CAS Name: 5-(4-chlorophenyl)-4-methyl-2-[(4-nitroanilino)-oxomethyl]-3H-pyrazole-4-carboxylic acid ethyl ester IUPAC Name: ethyl 5-(4-chlorophenyl)-4-methyl-2-[(4-nitrophenyl)carbamoyl]-3H-pyrazole-4-carboxylate Traditional Name: 3-(4-chlorophenyl)-4-methyl-1-[(4-nitrophenyl)carbamoyl]-2-pyrazoline-4-carboxylic acid ethyl ester Formula: C20H19ClN4O5 MolecularWeight: 430.84166

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CN(N=C1C2=CC=C(C=C2)Cl)C(=O)NC3=CC=C(C=C3)[N+](=O)[O-])C

Isomeric SMILES

CCOC(=O)C1(CN(N=C1C2=CC=C(C=C2)Cl)C(=O)NC3=CC=C(C=C3)[N+](=O)[O-])C

InChI

InChI=1S/C20H19ClN4O5/c1-3-30-18(26)20(2)12-24(23-17(20)13-4-6-14(21)7-5-13)19(27)22-15-8-10-16(11-9-15)25(28)29/h4-11H,3,12H2,1-2H3,(H,22,27)