methyl (4bS,8aR)-2-methoxy-4-methyl-6-oxidanylidene-4b,5,9,10-tetrahydrophenanthrene-8a-carboxylate

Systemtic Name: methyl (4bS,8aR)-2-methoxy-4-methyl-6-oxidanylidene-4b,5,9,10-tetrahydrophenanthrene-8a-carboxylate Openeye Name: methyl (4bS,8aR)-2-methoxy-4-methyl-6-oxo-4b,5,9,10-tetrahydrophenanthrene-8a-carboxylate CAS Name: (4bS,8aR)-2-methoxy-4-methyl-6-oxo-4b,5,9,10-tetrahydrophenanthrene-8a-carboxylic acid methyl ester IUPAC Name: methyl (4bS,8aR)-2-methoxy-4-methyl-6-oxo-4b,5,9,10-tetrahydrophenanthrene-8a-carboxylate Traditional Name: (4bS,8aR)-6-keto-2-methoxy-4-methyl-4b,5,9,10-tetrahydrophenanthrene-8a-carboxylic acid methyl ester Formula: C18H20O4 MolecularWeight: 300.349

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C3CC(=O)C=CC3(CCC2=CC(=C1)OC)C(=O)OC

Isomeric SMILES

CC1=C2[C@@H]3CC(=O)C=C[C@@]3(CCC2=CC(=C1)OC)C(=O)OC

InChI

InChI=1S/C18H20O4/c1-11-8-14(21-2)9-12-4-6-18(17(20)22-3)7-5-13(19)10-15(18)16(11)12/h5,7-9,15H,4,6,10H2,1-3H3/t15-,18+/m0/s1