methyl 5-[(E)-3-(dimethylamino)prop-2-enoyl]-1-(4,6-dimethylpyridin-2-yl)pyrazole-4-carboxylate

Systemtic Name: methyl 5-[(E)-3-(dimethylamino)prop-2-enoyl]-1-(4,6-dimethylpyridin-2-yl)pyrazole-4-carboxylate Openeye Name: methyl 5-[(E)-3-(dimethylamino)prop-2-enoyl]-1-(4,6-dimethyl-2-pyridyl)pyrazole-4-carboxylate CAS Name: 5-[(E)-3-(dimethylamino)-1-oxoprop-2-enyl]-1-(4,6-dimethyl-2-pyridinyl)-4-pyrazolecarboxylic acid methyl ester IUPAC Name: methyl 5-[(E)-3-(dimethylamino)prop-2-enoyl]-1-(4,6-dimethylpyridin-2-yl)pyrazole-4-carboxylate Traditional Name: 5-[(E)-3-(dimethylamino)acryloyl]-1-(4,6-dimethyl-2-pyridyl)pyrazole-4-carboxylic acid methyl ester Formula: C17H20N4O3 MolecularWeight: 328.3657

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=C1)N2C(=C(C=N2)C(=O)OC)C(=O)C=CN(C)C)C

Isomeric SMILES

CC1=CC(=NC(=C1)N2C(=C(C=N2)C(=O)OC)C(=O)/C=C/N(C)C)C

InChI

InChI=1S/C17H20N4O3/c1-11-8-12(2)19-15(9-11)21-16(14(22)6-7-20(3)4)13(10-18-21)17(23)24-5/h6-10H,1-5H3/b7-6+