methyl (3aR,6R,7aS)-6-acetyloxy-1,2-diphenyl-3,6,7,7a-tetrahydroindene-3a-carboxylate

Systemtic Name: methyl (3aR,6R,7aS)-6-acetyloxy-1,2-diphenyl-3,6,7,7a-tetrahydroindene-3a-carboxylate Openeye Name: methyl (3aR,6R,7aS)-6-acetoxy-1,2-diphenyl-3,6,7,7a-tetrahydroindene-3a-carboxylate CAS Name: (3aR,6R,7aS)-6-acetyloxy-1,2-diphenyl-3,6,7,7a-tetrahydroindene-3a-carboxylic acid methyl ester IUPAC Name: methyl (3aR,6R,7aS)-6-acetyloxy-1,2-diphenyl-3,6,7,7a-tetrahydroindene-3a-carboxylate Traditional Name: (3aR,6R,7aS)-6-acetoxy-1,2-diphenyl-3,6,7,7a-tetrahydroindene-3a-carboxylic acid methyl ester Formula: C25H24O4 MolecularWeight: 388.45566

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1CC2C(=C(CC2(C=C1)C(=O)OC)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC(=O)O[C@@H]1C[C@H]2C(=C(C[C@]2(C=C1)C(=O)OC)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C25H24O4/c1-17(26)29-20-13-14-25(24(27)28-2)16-21(18-9-5-3-6-10-18)23(22(25)15-20)19-11-7-4-8-12-19/h3-14,20,22H,15-16H2,1-2H3/t20-,22-,25-/m0/s1