(2S,4R)-1-(3,4-dimethylphenyl)carbonyl-4-oxidanyl-pyrrolidine-2-carboxylate

Systemtic Name: (2S,4R)-1-(3,4-dimethylphenyl)carbonyl-4-oxidanyl-pyrrolidine-2-carboxylate Openeye Name: (2S,4R)-1-(3,4-dimethylbenzoyl)-4-hydroxy-pyrrolidine-2-carboxylate CAS Name: (2S,4R)-1-[(3,4-dimethylphenyl)-oxomethyl]-4-hydroxy-2-pyrrolidinecarboxylate IUPAC Name: (2S,4R)-1-(3,4-dimethylbenzoyl)-4-hydroxypyrrolidine-2-carboxylate Traditional Name: (2S,4R)-1-(3,4-dimethylbenzoyl)-4-hydroxy-pyrrolidine-2-carboxylate Formula: C14H16NO4- MolecularWeight: 262.28114

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H17NO4/c1-8-3-4-10(5-9(8)2)13(17)15-7-11(16)6-12(15)14(18)19/h3-5,11-12,16H,6-7H2,1-2H3,(H,18,19)/p-1/t11-,12+/m1/s1