methyl 9-oxidanylidene-5,6,7,8-tetrahydrochrysene-6a-carboxylate

Systemtic Name: methyl 9-oxidanylidene-5,6,7,8-tetrahydrochrysene-6a-carboxylate Openeye Name: methyl 9-oxo-5,6,7,8-tetrahydrochrysene-6a-carboxylate CAS Name: 9-oxo-5,6,7,8-tetrahydrochrysene-6a-carboxylic acid methyl ester IUPAC Name: methyl 9-oxo-5,6,7,8-tetrahydrochrysene-6a-carboxylate Traditional Name: 9-keto-5,6,7,8-tetrahydrochrysene-6a-carboxylic acid methyl ester Formula: C20H18O3 MolecularWeight: 306.35512

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C12CCC(=O)C=C1C3=C(CC2)C4=CC=CC=C4C=C3

Isomeric SMILES

COC(=O)C12CCC(=O)C=C1C3=C(CC2)C4=CC=CC=C4C=C3

InChI

InChI=1S/C20H18O3/c1-23-19(22)20-10-8-14(21)12-18(20)17-7-6-13-4-2-3-5-15(13)16(17)9-11-20/h2-7,12H,8-11H2,1H3