ethyl (6aR,8S,9R)-3-oxidanyl-6-oxidanylidene-9-phenyl-6a,7,8,9-tetrahydrobenzo[c]chromene-8-carboxylate

Systemtic Name: ethyl (6aR,8S,9R)-3-oxidanyl-6-oxidanylidene-9-phenyl-6a,7,8,9-tetrahydrobenzo[c]chromene-8-carboxylate Openeye Name: ethyl (6aR,8S,9R)-3-hydroxy-6-oxo-9-phenyl-6a,7,8,9-tetrahydrobenzo[c]chromene-8-carboxylate CAS Name: (6aR,8S,9R)-3-hydroxy-6-oxo-9-phenyl-6a,7,8,9-tetrahydrobenzo[c][1]benzopyran-8-carboxylic acid ethyl ester IUPAC Name: ethyl (6aR,8S,9R)-3-hydroxy-6-oxo-9-phenyl-6a,7,8,9-tetrahydrobenzo[c]chromene-8-carboxylate Traditional Name: (6aR,8S,9R)-3-hydroxy-6-keto-9-phenyl-6a,7,8,9-tetrahydrobenzo[c]chromene-8-carboxylic acid ethyl ester Formula: C22H20O5 MolecularWeight: 364.3912

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CC2C(=CC1C3=CC=CC=C3)C4=C(C=C(C=C4)O)OC2=O

Isomeric SMILES

CCOC(=O)[C@H]1C[C@@H]2C(=C[C@H]1C3=CC=CC=C3)C4=C(C=C(C=C4)O)OC2=O

InChI

InChI=1S/C22H20O5/c1-2-26-21(24)18-12-19-17(11-16(18)13-6-4-3-5-7-13)15-9-8-14(23)10-20(15)27-22(19)25/h3-11,16,18-19,23H,2,12H2,1H3/t16-,18-,19+/m0/s1