methyl 1-methyl-5-oxidanylidene-6,7,8,9-tetrahydrobenzo[7]annulene-7-carboxylate

Systemtic Name: methyl 1-methyl-5-oxidanylidene-6,7,8,9-tetrahydrobenzo[7]annulene-7-carboxylate Openeye Name: methyl 1-methyl-5-oxo-6,7,8,9-tetrahydrobenzo[7]annulene-7-carboxylate CAS Name: 1-methyl-5-oxo-6,7,8,9-tetrahydrobenzo[7]annulene-7-carboxylic acid methyl ester IUPAC Name: methyl 1-methyl-5-oxo-6,7,8,9-tetrahydrobenzo[7]annulene-7-carboxylate Traditional Name: 5-keto-1-methyl-6,7,8,9-tetrahydrobenzocycloheptene-7-carboxylic acid methyl ester Formula: C14H16O3 MolecularWeight: 232.27504

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1CCC(CC2=O)C(=O)OC

Isomeric SMILES

CC1=CC=CC2=C1CCC(CC2=O)C(=O)OC

InChI

InChI=1S/C14H16O3/c1-9-4-3-5-12-11(9)7-6-10(8-13(12)15)14(16)17-2/h3-5,10H,6-8H2,1-2H3