methyl 2-[1-(4-methoxyphenyl)-4-[C-methyl-N-(pyridin-3-ylmethyl)carbonimidoyl]-5-oxidanylidene-4H-pyrazol-3-yl]ethanoate

Systemtic Name: methyl 2-[1-(4-methoxyphenyl)-4-[C-methyl-N-(pyridin-3-ylmethyl)carbonimidoyl]-5-oxidanylidene-4H-pyrazol-3-yl]ethanoate Openeye Name: methyl 2-[1-(4-methoxyphenyl)-4-[C-methyl-N-(3-pyridylmethyl)carbonimidoyl]-5-oxo-4H-pyrazol-3-yl]acetate CAS Name: 2-[1-(4-methoxyphenyl)-5-oxo-4-[1-(3-pyridinylmethylimino)ethyl]-4H-pyrazol-3-yl]acetic acid methyl ester IUPAC Name: methyl 2-[1-(4-methoxyphenyl)-4-[C-methyl-N-(pyridin-3-ylmethyl)carbonimidoyl]-5-oxo-4H-pyrazol-3-yl]acetate Traditional Name: 2-[5-keto-1-(4-methoxyphenyl)-4-[C-methyl-N-(3-pyridylmethyl)carbonimidoyl]-2-pyrazolin-3-yl]acetic acid methyl ester Formula: C21H22N4O4 MolecularWeight: 394.42378

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NCC1=CN=CC=C1)C2C(=NN(C2=O)C3=CC=C(C=C3)OC)CC(=O)OC

Isomeric SMILES

CC(=NCC1=CN=CC=C1)C2C(=NN(C2=O)C3=CC=C(C=C3)OC)CC(=O)OC

InChI

InChI=1S/C21H22N4O4/c1-14(23-13-15-5-4-10-22-12-15)20-18(11-19(26)29-3)24-25(21(20)27)16-6-8-17(28-2)9-7-16/h4-10,12,20H,11,13H2,1-3H3