3-[3-(4-octylphenyl)-2-oxidanylidene-imidazolidin-1-yl]propanoic acid

Systemtic Name: 3-[3-(4-octylphenyl)-2-oxidanylidene-imidazolidin-1-yl]propanoic acid Openeye Name: 3-[3-(4-octylphenyl)-2-oxo-imidazolidin-1-yl]propanoic acid CAS Name: 3-[3-(4-octylphenyl)-2-oxo-1-imidazolidinyl]propanoic acid IUPAC Name: 3-[3-(4-octylphenyl)-2-oxoimidazolidin-1-yl]propanoic acid Traditional Name: 3-[2-keto-3-(4-octylphenyl)imidazolidin-1-yl]propionic acid Formula: C20H30N2O3 MolecularWeight: 346.4638

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=C(C=C1)N2CCN(C2=O)CCC(=O)O

Isomeric SMILES

CCCCCCCCC1=CC=C(C=C1)N2CCN(C2=O)CCC(=O)O

InChI

InChI=1S/C20H30N2O3/c1-2-3-4-5-6-7-8-17-9-11-18(12-10-17)22-16-15-21(20(22)25)14-13-19(23)24/h9-12H,2-8,13-16H2,1H3,(H,23,24)