3-[4-[5-[4-(2-azanylpropan-2-yl)phenyl]-2-oxidanylidene-imidazolidin-1-yl]phenyl]propanoic acid

Systemtic Name: 3-[4-[5-[4-(2-azanylpropan-2-yl)phenyl]-2-oxidanylidene-imidazolidin-1-yl]phenyl]propanoic acid Openeye Name: 3-[4-[5-[4-(1-amino-1-methyl-ethyl)phenyl]-2-oxo-imidazolidin-1-yl]phenyl]propanoic acid CAS Name: 3-[4-[5-[4-(2-aminopropan-2-yl)phenyl]-2-oxo-1-imidazolidinyl]phenyl]propanoic acid IUPAC Name: 3-[4-[5-[4-(2-aminopropan-2-yl)phenyl]-2-oxoimidazolidin-1-yl]phenyl]propanoic acid Traditional Name: 3-[4-[5-[4-(1-amino-1-methyl-ethyl)phenyl]-2-keto-imidazolidin-1-yl]phenyl]propionic acid Formula: C21H25N3O3 MolecularWeight: 367.4415

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=CC=C(C=C1)C2CNC(=O)N2C3=CC=C(C=C3)CCC(=O)O)N

Isomeric SMILES

CC(C)(C1=CC=C(C=C1)C2CNC(=O)N2C3=CC=C(C=C3)CCC(=O)O)N

InChI

InChI=1S/C21H25N3O3/c1-21(2,22)16-8-6-15(7-9-16)18-13-23-20(27)24(18)17-10-3-14(4-11-17)5-12-19(25)26/h3-4,6-11,18H,5,12-13,22H2,1-2H3,(H,23,27)(H,25,26)