methyl 7-methoxy-2-oxidanylidene-3,4,9,10-tetrahydrophenanthrene-4a-carboxylate

Systemtic Name: methyl 7-methoxy-2-oxidanylidene-3,4,9,10-tetrahydrophenanthrene-4a-carboxylate Openeye Name: methyl 7-methoxy-2-oxo-3,4,9,10-tetrahydrophenanthrene-4a-carboxylate CAS Name: 7-methoxy-2-oxo-3,4,9,10-tetrahydrophenanthrene-4a-carboxylic acid methyl ester IUPAC Name: methyl 7-methoxy-2-oxo-3,4,9,10-tetrahydrophenanthrene-4a-carboxylate Traditional Name: 2-keto-7-methoxy-3,4,9,10-tetrahydrophenanthrene-4a-carboxylic acid methyl ester Formula: C17H18O4 MolecularWeight: 286.32242

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C3(CCC(=O)C=C3CC2)C(=O)OC

Isomeric SMILES

COC1=CC2=C(C=C1)C3(CCC(=O)C=C3CC2)C(=O)OC

InChI

InChI=1S/C17H18O4/c1-20-14-5-6-15-11(9-14)3-4-12-10-13(18)7-8-17(12,15)16(19)21-2/h5-6,9-10H,3-4,7-8H2,1-2H3