3-[4-[3-[2-(1-methylpiperidin-4-yl)ethyl]-2-oxidanylidene-imidazolidin-1-yl]phenyl]propanoic acid

Systemtic Name: 3-[4-[3-[2-(1-methylpiperidin-4-yl)ethyl]-2-oxidanylidene-imidazolidin-1-yl]phenyl]propanoic acid Openeye Name: 3-[4-[3-[2-(1-methyl-4-piperidyl)ethyl]-2-oxo-imidazolidin-1-yl]phenyl]propanoic acid CAS Name: 3-[4-[3-[2-(1-methyl-4-piperidinyl)ethyl]-2-oxo-1-imidazolidinyl]phenyl]propanoic acid IUPAC Name: 3-[4-[3-[2-(1-methylpiperidin-4-yl)ethyl]-2-oxoimidazolidin-1-yl]phenyl]propanoic acid Traditional Name: 3-[4-[2-keto-3-[2-(1-methyl-4-piperidyl)ethyl]imidazolidin-1-yl]phenyl]propionic acid Formula: C20H29N3O3 MolecularWeight: 359.46256

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(CC1)CCN2CCN(C2=O)C3=CC=C(C=C3)CCC(=O)O

Isomeric SMILES

CN1CCC(CC1)CCN2CCN(C2=O)C3=CC=C(C=C3)CCC(=O)O

InChI

InChI=1S/C20H29N3O3/c1-21-11-8-17(9-12-21)10-13-22-14-15-23(20(22)26)18-5-2-16(3-6-18)4-7-19(24)25/h2-3,5-6,17H,4,7-15H2,1H3,(H,24,25)