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

Systemtic Name: 4-[[1-[4-(2-imidazol-1-ylethoxy)phenyl]-5-oxidanylidene-pyrrolidin-3-yl]methoxy]benzoic acid Openeye Name: 4-[[1-[4-(2-imidazol-1-ylethoxy)phenyl]-5-oxo-pyrrolidin-3-yl]methoxy]benzoic acid CAS Name: 4-[[1-[4-[2-(1-imidazolyl)ethoxy]phenyl]-5-oxo-3-pyrrolidinyl]methoxy]benzoic acid IUPAC Name: 4-[[1-[4-(2-imidazol-1-ylethoxy)phenyl]-5-oxopyrrolidin-3-yl]methoxy]benzoic acid Traditional Name: 4-[[1-[4-(2-imidazol-1-ylethoxy)phenyl]-5-keto-pyrrolidin-3-yl]methoxy]benzoic acid Formula: C23H23N3O5 MolecularWeight: 421.44582

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(C1=O)C2=CC=C(C=C2)OCCN3C=CN=C3)COC4=CC=C(C=C4)C(=O)O

Isomeric SMILES

C1C(CN(C1=O)C2=CC=C(C=C2)OCCN3C=CN=C3)COC4=CC=C(C=C4)C(=O)O

InChI

InChI=1S/C23H23N3O5/c27-22-13-17(15-31-21-5-1-18(2-6-21)23(28)29)14-26(22)19-3-7-20(8-4-19)30-12-11-25-10-9-24-16-25/h1-10,16-17H,11-15H2,(H,28,29)