methyl 4-(3,6,6-trimethyl-4-oxidanylidene-5,7-dihydroindazol-1-yl)benzoate

Systemtic Name: methyl 4-(3,6,6-trimethyl-4-oxidanylidene-5,7-dihydroindazol-1-yl)benzoate Openeye Name: methyl 4-(3,6,6-trimethyl-4-oxo-5,7-dihydroindazol-1-yl)benzoate CAS Name: 4-(3,6,6-trimethyl-4-oxo-5,7-dihydroindazol-1-yl)benzoic acid methyl ester IUPAC Name: methyl 4-(3,6,6-trimethyl-4-oxo-5,7-dihydroindazol-1-yl)benzoate Traditional Name: 4-(4-keto-3,6,6-trimethyl-5,7-dihydroindazol-1-yl)benzoic acid methyl ester Formula: C18H20N2O3 MolecularWeight: 312.363

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C(=O)CC(C2)(C)C)C3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CC1=NN(C2=C1C(=O)CC(C2)(C)C)C3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C18H20N2O3/c1-11-16-14(9-18(2,3)10-15(16)21)20(19-11)13-7-5-12(6-8-13)17(22)23-4/h5-8H,9-10H2,1-4H3