prop-2-enyl 5-methyl-1-(4-nitrophenyl)pyrazole-4-carboxylate

Systemtic Name: prop-2-enyl 5-methyl-1-(4-nitrophenyl)pyrazole-4-carboxylate Openeye Name: allyl 5-methyl-1-(4-nitrophenyl)pyrazole-4-carboxylate CAS Name: 5-methyl-1-(4-nitrophenyl)-4-pyrazolecarboxylic acid prop-2-enyl ester IUPAC Name: prop-2-enyl 5-methyl-1-(4-nitrophenyl)pyrazole-4-carboxylate Traditional Name: 5-methyl-1-(4-nitrophenyl)pyrazole-4-carboxylic acid allyl ester Formula: C14H13N3O4 MolecularWeight: 287.27072

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C2=CC=C(C=C2)[N+](=O)[O-])C(=O)OCC=C

Isomeric SMILES

CC1=C(C=NN1C2=CC=C(C=C2)[N+](=O)[O-])C(=O)OCC=C

InChI

InChI=1S/C14H13N3O4/c1-3-8-21-14(18)13-9-15-16(10(13)2)11-4-6-12(7-5-11)17(19)20/h3-7,9H,1,8H2,2H3