methyl (2S,3S,3aS)-3-methoxy-3-phenyl-2,3a,4,5,6,7-hexahydroindene-2-carboxylate

Systemtic Name: methyl (2S,3S,3aS)-3-methoxy-3-phenyl-2,3a,4,5,6,7-hexahydroindene-2-carboxylate Openeye Name: methyl (2S,3S,3aS)-3-methoxy-3-phenyl-2,3a,4,5,6,7-hexahydroindene-2-carboxylate CAS Name: (2S,3S,3aS)-3-methoxy-3-phenyl-2,3a,4,5,6,7-hexahydroindene-2-carboxylic acid methyl ester IUPAC Name: methyl (2S,3S,3aS)-3-methoxy-3-phenyl-2,3a,4,5,6,7-hexahydroindene-2-carboxylate Traditional Name: (2S,3S,3aS)-3-methoxy-3-phenyl-2,3a,4,5,6,7-hexahydroindene-2-carboxylic acid methyl ester Formula: C18H22O3 MolecularWeight: 286.36548

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1C=C2CCCCC2C1(C3=CC=CC=C3)OC

Isomeric SMILES

COC(=O)[C@H]1C=C2CCCC[C@@H]2[C@]1(C3=CC=CC=C3)OC

InChI

InChI=1S/C18H22O3/c1-20-17(19)16-12-13-8-6-7-11-15(13)18(16,21-2)14-9-4-3-5-10-14/h3-5,9-10,12,15-16H,6-8,11H2,1-2H3/t15-,16+,18-/m0/s1