methyl 3-[[1-(2,4-dimethyl-6-oxidanylidene-pyran-3-yl)carbonylpyrazol-3-yl]carbonylamino]benzoate

Systemtic Name: methyl 3-[[1-(2,4-dimethyl-6-oxidanylidene-pyran-3-yl)carbonylpyrazol-3-yl]carbonylamino]benzoate Openeye Name: methyl 3-[[1-(2,4-dimethyl-6-oxo-pyran-3-carbonyl)pyrazole-3-carbonyl]amino]benzoate CAS Name: 3-[[[1-[(2,4-dimethyl-6-oxo-3-pyranyl)-oxomethyl]-3-pyrazolyl]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 3-[[1-(2,4-dimethyl-6-oxopyran-3-carbonyl)pyrazole-3-carbonyl]amino]benzoate Traditional Name: 3-[[1-(6-keto-2,4-dimethyl-pyran-3-carbonyl)pyrazole-3-carbonyl]amino]benzoic acid methyl ester Formula: C20H17N3O6 MolecularWeight: 395.36548

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC(=C1C(=O)N2C=CC(=N2)C(=O)NC3=CC=CC(=C3)C(=O)OC)C

Isomeric SMILES

CC1=CC(=O)OC(=C1C(=O)N2C=CC(=N2)C(=O)NC3=CC=CC(=C3)C(=O)OC)C

InChI

InChI=1S/C20H17N3O6/c1-11-9-16(24)29-12(2)17(11)19(26)23-8-7-15(22-23)18(25)21-14-6-4-5-13(10-14)20(27)28-3/h4-10H,1-3H3,(H,21,25)