O1-methyl O2-(phenylmethyl) (3R,6S)-3,6-dimethylcyclohexa-1,4-diene-1,2-dicarboxylate

Systemtic Name: O1-methyl O2-(phenylmethyl) (3R,6S)-3,6-dimethylcyclohexa-1,4-diene-1,2-dicarboxylate Openeye Name: O2-benzyl O1-methyl (3R,6S)-3,6-dimethylcyclohexa-1,4-diene-1,2-dicarboxylate CAS Name: (3R,6S)-3,6-dimethylcyclohexa-1,4-diene-1,2-dicarboxylic acid O1-methyl ester O2-(phenylmethyl) ester IUPAC Name: 2-O-benzyl 1-O-methyl (3R,6S)-3,6-dimethylcyclohexa-1,4-diene-1,2-dicarboxylate Traditional Name: (3R,6S)-3,6-dimethylcyclohexa-1,4-diene-1,2-dicarboxylic acid O2-benzyl ester O1-methyl ester Formula: C18H20O4 MolecularWeight: 300.349

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Descriptors Computed from Structure

Canonical SMILES:

CC1C=CC(C(=C1C(=O)OC)C(=O)OCC2=CC=CC=C2)C

Isomeric SMILES

C[C@H]1C=C[C@H](C(=C1C(=O)OC)C(=O)OCC2=CC=CC=C2)C

InChI

InChI=1S/C18H20O4/c1-12-9-10-13(2)16(15(12)17(19)21-3)18(20)22-11-14-7-5-4-6-8-14/h4-10,12-13H,11H2,1-3H3/t12-,13+/m0/s1