methyl 5-methyl-1-(C-phenyl-N-prop-2-enyl-carbonimidoyl)pyrazole-3-carboxylate

Systemtic Name: methyl 5-methyl-1-(C-phenyl-N-prop-2-enyl-carbonimidoyl)pyrazole-3-carboxylate Openeye Name: methyl 1-(N-allyl-C-phenyl-carbonimidoyl)-5-methyl-pyrazole-3-carboxylate CAS Name: 5-methyl-1-[phenyl(prop-2-enylimino)methyl]-3-pyrazolecarboxylic acid methyl ester IUPAC Name: methyl 5-methyl-1-(C-phenyl-N-prop-2-enylcarbonimidoyl)pyrazole-3-carboxylate Traditional Name: 1-(N-allyl-C-phenyl-carbonimidoyl)-5-methyl-pyrazole-3-carboxylic acid methyl ester Formula: C16H17N3O2 MolecularWeight: 283.32508

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C(=NCC=C)C2=CC=CC=C2)C(=O)OC

Isomeric SMILES

CC1=CC(=NN1C(=NCC=C)C2=CC=CC=C2)C(=O)OC

InChI

InChI=1S/C16H17N3O2/c1-4-10-17-15(13-8-6-5-7-9-13)19-12(2)11-14(18-19)16(20)21-3/h4-9,11H,1,10H2,2-3H3