methyl 4-[[2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-2-oxidanylidene-ethanoyl]amino]-3-methyl-benzoate

Systemtic Name: methyl 4-[[2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-2-oxidanylidene-ethanoyl]amino]-3-methyl-benzoate Openeye Name: methyl 4-[[2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-2-oxo-acetyl]amino]-3-methyl-benzoate CAS Name: 4-[[2-(3,5-dimethyl-1-phenyl-4-pyrazolyl)-1,2-dioxoethyl]amino]-3-methylbenzoic acid methyl ester IUPAC Name: methyl 4-[[2-(3,5-dimethyl-1-phenylpyrazol-4-yl)-2-oxoacetyl]amino]-3-methylbenzoate Traditional Name: 4-[[2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-2-keto-acetyl]amino]-3-methyl-benzoic acid methyl ester Formula: C22H21N3O4 MolecularWeight: 391.41984

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)OC)NC(=O)C(=O)C2=C(N(N=C2C)C3=CC=CC=C3)C

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)OC)NC(=O)C(=O)C2=C(N(N=C2C)C3=CC=CC=C3)C

InChI

InChI=1S/C22H21N3O4/c1-13-12-16(22(28)29-4)10-11-18(13)23-21(27)20(26)19-14(2)24-25(15(19)3)17-8-6-5-7-9-17/h5-12H,1-4H3,(H,23,27)