dimethyl (3R,5S,6R,8S)-2-methylcubane-1,4-dicarboxylate

Systemtic Name: dimethyl (3R,5S,6R,8S)-2-methylcubane-1,4-dicarboxylate Openeye Name: dimethyl (3R,5S,6R,8S)-2-methylcubane-1,4-dicarboxylate CAS Name: (3R,5S,6R,8S)-2-methylcubane-1,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl (3R,5S,6R,8S)-2-methylcubane-1,4-dicarboxylate Traditional Name: (3R,5S,6R,8S)-2-methylcubane-1,4-dicarboxylic acid dimethyl ester Formula: C13H14O4 MolecularWeight: 234.24786

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Descriptors Computed from Structure

Canonical SMILES:

CC12C3C4C1(C5C4C3(C25)C(=O)OC)C(=O)OC

Isomeric SMILES

CC12[C@H]3[C@H]4C1([C@H]5[C@@H]2C3(C45)C(=O)OC)C(=O)OC

InChI

InChI=1S/C13H14O4/c1-11-7-5-4-6(13(5,11)10(15)17-3)8(11)12(4,7)9(14)16-2/h4-8H,1-3H3/t4?,5-,6+,7+,8-,11?,12?,13?