4-[[1-[4-(2,2-dimethylpropanoylamino)phenyl]-5-oxidanylidene-pyrrolidin-3-yl]methoxy]benzoic acid

Systemtic Name: 4-[[1-[4-(2,2-dimethylpropanoylamino)phenyl]-5-oxidanylidene-pyrrolidin-3-yl]methoxy]benzoic acid Openeye Name: 4-[[1-[4-(2,2-dimethylpropanoylamino)phenyl]-5-oxo-pyrrolidin-3-yl]methoxy]benzoic acid CAS Name: 4-[[1-[4-[(2,2-dimethyl-1-oxopropyl)amino]phenyl]-5-oxo-3-pyrrolidinyl]methoxy]benzoic acid IUPAC Name: 4-[[1-[4-(2,2-dimethylpropanoylamino)phenyl]-5-oxopyrrolidin-3-yl]methoxy]benzoic acid Traditional Name: 4-[[5-keto-1-[4-(pivaloylamino)phenyl]pyrrolidin-3-yl]methoxy]benzoic acid Formula: C23H26N2O5 MolecularWeight: 410.46294

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)NC1=CC=C(C=C1)N2CC(CC2=O)COC3=CC=C(C=C3)C(=O)O

Isomeric SMILES

CC(C)(C)C(=O)NC1=CC=C(C=C1)N2CC(CC2=O)COC3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C23H26N2O5/c1-23(2,3)22(29)24-17-6-8-18(9-7-17)25-13-15(12-20(25)26)14-30-19-10-4-16(5-11-19)21(27)28/h4-11,15H,12-14H2,1-3H3,(H,24,29)(H,27,28)