dimethyl (2S,6aS)-5,5-dimethyl-2-phenyl-2,3,6,6a-tetrahydropentalene-1,1-dicarboxylate

Systemtic Name: dimethyl (2S,6aS)-5,5-dimethyl-2-phenyl-2,3,6,6a-tetrahydropentalene-1,1-dicarboxylate Openeye Name: dimethyl (2S,6aS)-5,5-dimethyl-2-phenyl-2,3,6,6a-tetrahydropentalene-1,1-dicarboxylate CAS Name: (2S,6aS)-5,5-dimethyl-2-phenyl-2,3,6,6a-tetrahydropentalene-1,1-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl (2S,6aS)-5,5-dimethyl-2-phenyl-2,3,6,6a-tetrahydropentalene-1,1-dicarboxylate Traditional Name: (2S,6aS)-5,5-dimethyl-2-phenyl-2,3,6,6a-tetrahydropentalene-1,1-dicarboxylic acid dimethyl ester Formula: C20H24O4 MolecularWeight: 328.40216

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2C(=C1)CC(C2(C(=O)OC)C(=O)OC)C3=CC=CC=C3)C

Isomeric SMILES

CC1(C[C@H]2C(=C1)C[C@H](C2(C(=O)OC)C(=O)OC)C3=CC=CC=C3)C

InChI

InChI=1S/C20H24O4/c1-19(2)11-14-10-15(13-8-6-5-7-9-13)20(16(14)12-19,17(21)23-3)18(22)24-4/h5-9,11,15-16H,10,12H2,1-4H3/t15-,16-/m0/s1