(3R,4S)-1-tert-butyl-4-(4-methoxyphenyl)pyrrolidine-3-carboxylic acid

Systemtic Name: (3R,4S)-1-tert-butyl-4-(4-methoxyphenyl)pyrrolidine-3-carboxylic acid Openeye Name: (3R,4S)-1-tert-butyl-4-(4-methoxyphenyl)pyrrolidine-3-carboxylic acid CAS Name: (3R,4S)-1-tert-butyl-4-(4-methoxyphenyl)-3-pyrrolidinecarboxylic acid IUPAC Name: (3R,4S)-1-tert-butyl-4-(4-methoxyphenyl)pyrrolidine-3-carboxylic acid Traditional Name: (3R,4S)-1-tert-butyl-4-(4-methoxyphenyl)pyrrolidine-3-carboxylic acid Formula: C16H23NO3 MolecularWeight: 277.35872

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1CC(C(C1)C(=O)O)C2=CC=C(C=C2)OC

Isomeric SMILES

CC(C)(C)N1C[C@@H]([C@H](C1)C(=O)O)C2=CC=C(C=C2)OC

InChI

InChI=1S/C16H23NO3/c1-16(2,3)17-9-13(14(10-17)15(18)19)11-5-7-12(20-4)8-6-11/h5-8,13-14H,9-10H2,1-4H3,(H,18,19)/t13-,14+/m1/s1