3-[3-[1-(4-tert-butylphenyl)-3-oxidanylidene-pyrrolidin-2-yl]propoxy]propanoic acid

Systemtic Name: 3-[3-[1-(4-tert-butylphenyl)-3-oxidanylidene-pyrrolidin-2-yl]propoxy]propanoic acid Openeye Name: 3-[3-[1-(4-tert-butylphenyl)-3-oxo-pyrrolidin-2-yl]propoxy]propanoic acid CAS Name: 3-[3-[1-(4-tert-butylphenyl)-3-oxo-2-pyrrolidinyl]propoxy]propanoic acid IUPAC Name: 3-[3-[1-(4-tert-butylphenyl)-3-oxopyrrolidin-2-yl]propoxy]propanoic acid Traditional Name: 3-[3-[1-(4-tert-butylphenyl)-3-keto-pyrrolidin-2-yl]propoxy]propionic acid Formula: C20H29NO4 MolecularWeight: 347.44856

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)N2CCC(=O)C2CCCOCCC(=O)O

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)N2CCC(=O)C2CCCOCCC(=O)O

InChI

InChI=1S/C20H29NO4/c1-20(2,3)15-6-8-16(9-7-15)21-12-10-18(22)17(21)5-4-13-25-14-11-19(23)24/h6-9,17H,4-5,10-14H2,1-3H3,(H,23,24)