(2R,4S)-4-methoxy-1-(2,4,6-trimethylphenyl)carbonyl-pyrrolidine-2-carboxylate

Systemtic Name: (2R,4S)-4-methoxy-1-(2,4,6-trimethylphenyl)carbonyl-pyrrolidine-2-carboxylate Openeye Name: (2R,4S)-4-methoxy-1-(2,4,6-trimethylbenzoyl)pyrrolidine-2-carboxylate CAS Name: (2R,4S)-4-methoxy-1-[oxo-(2,4,6-trimethylphenyl)methyl]-2-pyrrolidinecarboxylate IUPAC Name: (2R,4S)-4-methoxy-1-(2,4,6-trimethylbenzoyl)pyrrolidine-2-carboxylate Traditional Name: (2R,4S)-4-methoxy-1-(2,4,6-trimethylbenzoyl)pyrrolidine-2-carboxylate Formula: C16H20NO4- MolecularWeight: 290.3343

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)C(=O)N2CC(CC2C(=O)[O-])OC)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)C(=O)N2C[C@H](C[C@@H]2C(=O)[O-])OC)C

InChI

InChI=1S/C16H21NO4/c1-9-5-10(2)14(11(3)6-9)15(18)17-8-12(21-4)7-13(17)16(19)20/h5-6,12-13H,7-8H2,1-4H3,(H,19,20)/p-1/t12-,13+/m0/s1