(2S)-1-(2,5-dimethylphenyl)carbonylpyrrolidine-2-carboxylate

Systemtic Name: (2S)-1-(2,5-dimethylphenyl)carbonylpyrrolidine-2-carboxylate Openeye Name: (2S)-1-(2,5-dimethylbenzoyl)pyrrolidine-2-carboxylate CAS Name: (2S)-1-[(2,5-dimethylphenyl)-oxomethyl]-2-pyrrolidinecarboxylate IUPAC Name: (2S)-1-(2,5-dimethylbenzoyl)pyrrolidine-2-carboxylate Traditional Name: (2S)-1-(2,5-dimethylbenzoyl)pyrrolidine-2-carboxylate Formula: C14H16NO3- MolecularWeight: 246.28174

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C(=O)N2CCCC2C(=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)C)C(=O)N2CCC[C@H]2C(=O)[O-]

InChI

InChI=1S/C14H17NO3/c1-9-5-6-10(2)11(8-9)13(16)15-7-3-4-12(15)14(17)18/h5-6,8,12H,3-4,7H2,1-2H3,(H,17,18)/p-1/t12-/m0/s1