3-[2-[4-[(4,5-dihydro-1H-imidazol-2-ylamino)methyl]phenoxy]pyrimidin-4-yl]propanoic acid

Systemtic Name: 3-[2-[4-[(4,5-dihydro-1H-imidazol-2-ylamino)methyl]phenoxy]pyrimidin-4-yl]propanoic acid Openeye Name: 3-[2-[4-[(4,5-dihydro-1H-imidazol-2-ylamino)methyl]phenoxy]pyrimidin-4-yl]propanoic acid CAS Name: 3-[2-[4-[(4,5-dihydro-1H-imidazol-2-ylamino)methyl]phenoxy]-4-pyrimidinyl]propanoic acid IUPAC Name: 3-[2-[4-[(4,5-dihydro-1H-imidazol-2-ylamino)methyl]phenoxy]pyrimidin-4-yl]propanoic acid Traditional Name: 3-[2-[4-[(2-imidazolin-2-ylamino)methyl]phenoxy]pyrimidin-4-yl]propionic acid Formula: C17H19N5O3 MolecularWeight: 341.36446

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Descriptors Computed from Structure

Canonical SMILES:

C1CN=C(N1)NCC2=CC=C(C=C2)OC3=NC=CC(=N3)CCC(=O)O

Isomeric SMILES

C1CN=C(N1)NCC2=CC=C(C=C2)OC3=NC=CC(=N3)CCC(=O)O

InChI

InChI=1S/C17H19N5O3/c23-15(24)6-3-13-7-8-20-17(22-13)25-14-4-1-12(2-5-14)11-21-16-18-9-10-19-16/h1-2,4-5,7-8H,3,6,9-11H2,(H,23,24)(H2,18,19,21)