O2-ethyl O3,O3'-dimethyl 5-ethynyl-1-(4-methylphenyl)pyrrolidine-2,3,3-tricarboxylate

Systemtic Name: O2-ethyl O3,O3'-dimethyl 5-ethynyl-1-(4-methylphenyl)pyrrolidine-2,3,3-tricarboxylate Openeye Name: O2-ethyl O3,O3'-dimethyl 5-ethynyl-1-(p-tolyl)pyrrolidine-2,3,3-tricarboxylate CAS Name: 5-ethynyl-1-(4-methylphenyl)pyrrolidine-2,3,3-tricarboxylic acid O2-ethyl ester O3,O3'-dimethyl ester IUPAC Name: 2-O-ethyl 3-O,3-O'-dimethyl 5-ethynyl-1-(4-methylphenyl)pyrrolidine-2,3,3-tricarboxylate Traditional Name: 5-ethynyl-1-(p-tolyl)pyrrolidine-2,3,3-tricarboxylic acid O2-ethyl ester O3,O3'-dimethyl ester Formula: C20H23NO6 MolecularWeight: 373.39972

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(CC(N1C2=CC=C(C=C2)C)C#C)(C(=O)OC)C(=O)OC

Isomeric SMILES

CCOC(=O)C1C(CC(N1C2=CC=C(C=C2)C)C#C)(C(=O)OC)C(=O)OC

InChI

InChI=1S/C20H23NO6/c1-6-14-12-20(18(23)25-4,19(24)26-5)16(17(22)27-7-2)21(14)15-10-8-13(3)9-11-15/h1,8-11,14,16H,7,12H2,2-5H3