ethyl 4-(4-methoxyphenyl)-5-(4-methylphenyl)carbonyl-2-nitroso-3,4-dihydropyrazole-3-carboxylate

Systemtic Name: ethyl 4-(4-methoxyphenyl)-5-(4-methylphenyl)carbonyl-2-nitroso-3,4-dihydropyrazole-3-carboxylate Openeye Name: ethyl 4-(4-methoxyphenyl)-5-(4-methylbenzoyl)-2-nitroso-3,4-dihydropyrazole-3-carboxylate CAS Name: 4-(4-methoxyphenyl)-5-[(4-methylphenyl)-oxomethyl]-2-nitroso-3,4-dihydropyrazole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-methoxyphenyl)-5-(4-methylbenzoyl)-2-nitroso-3,4-dihydropyrazole-3-carboxylate Traditional Name: 4-(4-methoxyphenyl)-2-nitroso-5-p-toluoyl-2-pyrazoline-3-carboxylic acid ethyl ester Formula: C21H21N3O5 MolecularWeight: 395.40854

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(C(=NN1N=O)C(=O)C2=CC=C(C=C2)C)C3=CC=C(C=C3)OC

Isomeric SMILES

CCOC(=O)C1C(C(=NN1N=O)C(=O)C2=CC=C(C=C2)C)C3=CC=C(C=C3)OC

InChI

InChI=1S/C21H21N3O5/c1-4-29-21(26)19-17(14-9-11-16(28-3)12-10-14)18(22-24(19)23-27)20(25)15-7-5-13(2)6-8-15/h5-12,17,19H,4H2,1-3H3