4-[3-(3,5-ditert-butylphenyl)-2-oxidanylidene-imidazolidin-1-yl]benzoic acid

Systemtic Name: 4-[3-(3,5-ditert-butylphenyl)-2-oxidanylidene-imidazolidin-1-yl]benzoic acid Openeye Name: 4-[3-(3,5-ditert-butylphenyl)-2-oxo-imidazolidin-1-yl]benzoic acid CAS Name: 4-[3-(3,5-ditert-butylphenyl)-2-oxo-1-imidazolidinyl]benzoic acid IUPAC Name: 4-[3-(3,5-ditert-butylphenyl)-2-oxoimidazolidin-1-yl]benzoic acid Traditional Name: 4-[3-(3,5-ditert-butylphenyl)-2-keto-imidazolidin-1-yl]benzoic acid Formula: C24H30N2O3 MolecularWeight: 394.5066

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1)N2CCN(C2=O)C3=CC=C(C=C3)C(=O)O)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1)N2CCN(C2=O)C3=CC=C(C=C3)C(=O)O)C(C)(C)C

InChI

InChI=1S/C24H30N2O3/c1-23(2,3)17-13-18(24(4,5)6)15-20(14-17)26-12-11-25(22(26)29)19-9-7-16(8-10-19)21(27)28/h7-10,13-15H,11-12H2,1-6H3,(H,27,28)