3-[4-[2-oxidanylidene-3-[4-(propylaminomethyl)phenyl]imidazolidin-4-yl]phenyl]propanoic acid

Systemtic Name: 3-[4-[2-oxidanylidene-3-[4-(propylaminomethyl)phenyl]imidazolidin-4-yl]phenyl]propanoic acid Openeye Name: 3-[4-[2-oxo-3-[4-(propylaminomethyl)phenyl]imidazolidin-4-yl]phenyl]propanoic acid CAS Name: 3-[4-[2-oxo-3-[4-(propylaminomethyl)phenyl]-4-imidazolidinyl]phenyl]propanoic acid IUPAC Name: 3-[4-[2-oxo-3-[4-(propylaminomethyl)phenyl]imidazolidin-4-yl]phenyl]propanoic acid Traditional Name: 3-[4-[2-keto-3-[4-(propylaminomethyl)phenyl]imidazolidin-4-yl]phenyl]propionic acid Formula: C22H27N3O3 MolecularWeight: 381.46808

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Descriptors Computed from Structure

Canonical SMILES:

CCCNCC1=CC=C(C=C1)N2C(CNC2=O)C3=CC=C(C=C3)CCC(=O)O

Isomeric SMILES

CCCNCC1=CC=C(C=C1)N2C(CNC2=O)C3=CC=C(C=C3)CCC(=O)O

InChI

InChI=1S/C22H27N3O3/c1-2-13-23-14-17-5-10-19(11-6-17)25-20(15-24-22(25)28)18-8-3-16(4-9-18)7-12-21(26)27/h3-6,8-11,20,23H,2,7,12-15H2,1H3,(H,24,28)(H,26,27)