2-[(4-tert-butyl-2-oxidanylidene-pyrrolidin-1-yl)methyl]benzoic acid

Systemtic Name: 2-[(4-tert-butyl-2-oxidanylidene-pyrrolidin-1-yl)methyl]benzoic acid Openeye Name: 2-[(4-tert-butyl-2-oxo-pyrrolidin-1-yl)methyl]benzoic acid CAS Name: 2-[(4-tert-butyl-2-oxo-1-pyrrolidinyl)methyl]benzoic acid IUPAC Name: 2-[(4-tert-butyl-2-oxopyrrolidin-1-yl)methyl]benzoic acid Traditional Name: 2-[(4-tert-butyl-2-keto-pyrrolidino)methyl]benzoic acid Formula: C16H21NO3 MolecularWeight: 275.34284

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CC(=O)N(C1)CC2=CC=CC=C2C(=O)O

Isomeric SMILES

CC(C)(C)C1CC(=O)N(C1)CC2=CC=CC=C2C(=O)O

InChI

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