(2S)-1-(3,4-diethoxyphenyl)carbonylpyrrolidine-2-carboxylic acid

Systemtic Name: (2S)-1-(3,4-diethoxyphenyl)carbonylpyrrolidine-2-carboxylic acid Openeye Name: (2S)-1-(3,4-diethoxybenzoyl)pyrrolidine-2-carboxylic acid CAS Name: (2S)-1-[(3,4-diethoxyphenyl)-oxomethyl]-2-pyrrolidinecarboxylic acid IUPAC Name: (2S)-1-(3,4-diethoxybenzoyl)pyrrolidine-2-carboxylic acid Traditional Name: (2S)-1-(3,4-diethoxybenzoyl)proline Formula: C16H21NO5 MolecularWeight: 307.34164

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)N2CCCC2C(=O)O)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)N2CCC[C@H]2C(=O)O)OCC

InChI

InChI=1S/C16H21NO5/c1-3-21-13-8-7-11(10-14(13)22-4-2)15(18)17-9-5-6-12(17)16(19)20/h7-8,10,12H,3-6,9H2,1-2H3,(H,19,20)/t12-/m0/s1