dimethyl (3S,4S)-3-methanoyl-4-phenacyl-cyclopentane-1,1-dicarboxylate

Systemtic Name: dimethyl (3S,4S)-3-methanoyl-4-phenacyl-cyclopentane-1,1-dicarboxylate Openeye Name: dimethyl (3S,4S)-3-formyl-4-phenacyl-cyclopentane-1,1-dicarboxylate CAS Name: (3S,4S)-3-formyl-4-phenacylcyclopentane-1,1-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl (3S,4S)-3-formyl-4-phenacylcyclopentane-1,1-dicarboxylate Traditional Name: (3S,4S)-3-formyl-4-phenacyl-cyclopentane-1,1-dicarboxylic acid dimethyl ester Formula: C18H20O6 MolecularWeight: 332.3478

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1(CC(C(C1)C=O)CC(=O)C2=CC=CC=C2)C(=O)OC

Isomeric SMILES

COC(=O)C1(C[C@H]([C@H](C1)C=O)CC(=O)C2=CC=CC=C2)C(=O)OC

InChI

InChI=1S/C18H20O6/c1-23-16(21)18(17(22)24-2)9-13(14(10-18)11-19)8-15(20)12-6-4-3-5-7-12/h3-7,11,13-14H,8-10H2,1-2H3/t13-,14-/m1/s1