O3-ethyl O2-(phenylmethyl) (3S,3aS,6aS)-6-(3,4-dimethylphenyl)-3,3a,4,6a-tetrahydro-1H-cyclopenta[c]pyrrole-2,3-dicarboxylate

Systemtic Name: O3-ethyl O2-(phenylmethyl) (3S,3aS,6aS)-6-(3,4-dimethylphenyl)-3,3a,4,6a-tetrahydro-1H-cyclopenta[c]pyrrole-2,3-dicarboxylate Openeye Name: O2-benzyl O3-ethyl (3S,3aS,6aS)-6-(3,4-dimethylphenyl)-3,3a,4,6a-tetrahydro-1H-cyclopenta[c]pyrrole-2,3-dicarboxylate CAS Name: (3S,3aS,6aS)-6-(3,4-dimethylphenyl)-3,3a,4,6a-tetrahydro-1H-cyclopenta[c]pyrrole-2,3-dicarboxylic acid O3-ethyl ester O2-(phenylmethyl) ester IUPAC Name: 2-O-benzyl 3-O-ethyl (3S,3aS,6aS)-6-(3,4-dimethylphenyl)-3,3a,4,6a-tetrahydro-1H-cyclopenta[c]pyrrole-2,3-dicarboxylate Traditional Name: (3S,3aS,6aS)-6-(3,4-dimethylphenyl)-3,3a,4,6a-tetrahydro-1H-cyclopenta[c]pyrrole-2,3-dicarboxylic acid O2-benzyl ester O3-ethyl ester Formula: C26H29NO4 MolecularWeight: 419.51276

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C2CC=C(C2CN1C(=O)OCC3=CC=CC=C3)C4=CC(=C(C=C4)C)C

Isomeric SMILES

CCOC(=O)[C@@H]1[C@H]2CC=C([C@H]2CN1C(=O)OCC3=CC=CC=C3)C4=CC(=C(C=C4)C)C

InChI

InChI=1S/C26H29NO4/c1-4-30-25(28)24-22-13-12-21(20-11-10-17(2)18(3)14-20)23(22)15-27(24)26(29)31-16-19-8-6-5-7-9-19/h5-12,14,22-24H,4,13,15-16H2,1-3H3/t22-,23+,24-/m0/s1