(2S,5R)-5-(4-tert-butylphenyl)-1-methanoyl-pyrrolidine-2-carboxylic acid

Systemtic Name: (2S,5R)-5-(4-tert-butylphenyl)-1-methanoyl-pyrrolidine-2-carboxylic acid Openeye Name: (2S,5R)-5-(4-tert-butylphenyl)-1-formyl-pyrrolidine-2-carboxylic acid CAS Name: (2S,5R)-5-(4-tert-butylphenyl)-1-formyl-2-pyrrolidinecarboxylic acid IUPAC Name: (2S,5R)-5-(4-tert-butylphenyl)-1-formylpyrrolidine-2-carboxylic acid Traditional Name: (2S,5R)-5-(4-tert-butylphenyl)-1-formyl-proline Formula: C16H21NO3 MolecularWeight: 275.34284

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2CCC(N2C=O)C(=O)O

Isomeric SMILES

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

InChI

InChI=1S/C16H21NO3/c1-16(2,3)12-6-4-11(5-7-12)13-8-9-14(15(19)20)17(13)10-18/h4-7,10,13-14H,8-9H2,1-3H3,(H,19,20)/t13-,14+/m1/s1