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

Systemtic Name: methyl 2-[1-(4-methoxyphenyl)-4-[C-methyl-N-(phenylmethyl)carbonimidoyl]-5-oxidanylidene-4H-pyrazol-3-yl]ethanoate Openeye Name: methyl 2-[4-(N-benzyl-C-methyl-carbonimidoyl)-1-(4-methoxyphenyl)-5-oxo-4H-pyrazol-3-yl]acetate CAS Name: 2-[1-(4-methoxyphenyl)-5-oxo-4-[1-(phenylmethyl)iminoethyl]-4H-pyrazol-3-yl]acetic acid methyl ester IUPAC Name: methyl 2-[4-(N-benzyl-C-methylcarbonimidoyl)-1-(4-methoxyphenyl)-5-oxo-4H-pyrazol-3-yl]acetate Traditional Name: 2-[4-(N-benzyl-C-methyl-carbonimidoyl)-5-keto-1-(4-methoxyphenyl)-2-pyrazolin-3-yl]acetic acid methyl ester Formula: C22H23N3O4 MolecularWeight: 393.43572

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H23N3O4/c1-15(23-14-16-7-5-4-6-8-16)21-19(13-20(26)29-3)24-25(22(21)27)17-9-11-18(28-2)12-10-17/h4-12,21H,13-14H2,1-3H3