methyl 8,8-dimethyl-5-oxidanylidene-4a,8a-dihydro-2H-chromene-3-carboxylate

Systemtic Name: methyl 8,8-dimethyl-5-oxidanylidene-4a,8a-dihydro-2H-chromene-3-carboxylate Openeye Name: methyl 8,8-dimethyl-5-oxo-4a,8a-dihydro-2H-chromene-3-carboxylate CAS Name: 8,8-dimethyl-5-oxo-4a,8a-dihydro-2H-1-benzopyran-3-carboxylic acid methyl ester IUPAC Name: methyl 8,8-dimethyl-5-oxo-4a,8a-dihydro-2H-chromene-3-carboxylate Traditional Name: 5-keto-8,8-dimethyl-4a,8a-dihydro-2H-chromene-3-carboxylic acid methyl ester Formula: C13H16O4 MolecularWeight: 236.26374

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C=CC(=O)C2C1OCC(=C2)C(=O)OC)C

Isomeric SMILES

CC1(C=CC(=O)C2C1OCC(=C2)C(=O)OC)C

InChI

InChI=1S/C13H16O4/c1-13(2)5-4-10(14)9-6-8(12(15)16-3)7-17-11(9)13/h4-6,9,11H,7H2,1-3H3