methyl 2-[4-(N-tert-butyl-C-methyl-carbonimidoyl)-5-oxidanylidene-1-phenyl-4H-pyrazol-3-yl]ethanoate

Systemtic Name: methyl 2-[4-(N-tert-butyl-C-methyl-carbonimidoyl)-5-oxidanylidene-1-phenyl-4H-pyrazol-3-yl]ethanoate Openeye Name: methyl 2-[4-(N-tert-butyl-C-methyl-carbonimidoyl)-5-oxo-1-phenyl-4H-pyrazol-3-yl]acetate CAS Name: 2-[4-(1-tert-butyliminoethyl)-5-oxo-1-phenyl-4H-pyrazol-3-yl]acetic acid methyl ester IUPAC Name: methyl 2-[4-(N-tert-butyl-C-methylcarbonimidoyl)-5-oxo-1-phenyl-4H-pyrazol-3-yl]acetate Traditional Name: 2-[4-(N-tert-butyl-C-methyl-carbonimidoyl)-5-keto-1-phenyl-2-pyrazolin-3-yl]acetic acid methyl ester Formula: C18H23N3O3 MolecularWeight: 329.39352

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NC(C)(C)C)C1C(=NN(C1=O)C2=CC=CC=C2)CC(=O)OC

Isomeric SMILES

CC(=NC(C)(C)C)C1C(=NN(C1=O)C2=CC=CC=C2)CC(=O)OC

InChI

InChI=1S/C18H23N3O3/c1-12(19-18(2,3)4)16-14(11-15(22)24-5)20-21(17(16)23)13-9-7-6-8-10-13/h6-10,16H,11H2,1-5H3