(E)-5-[2-(4,5-dihydro-1H-imidazol-2-ylamino)phenyl]-3-oxidanylidene-2-phenoxy-pent-4-enoic acid

Systemtic Name: (E)-5-[2-(4,5-dihydro-1H-imidazol-2-ylamino)phenyl]-3-oxidanylidene-2-phenoxy-pent-4-enoic acid Openeye Name: (E)-5-[2-(4,5-dihydro-1H-imidazol-2-ylamino)phenyl]-3-oxo-2-phenoxy-pent-4-enoic acid CAS Name: (E)-5-[2-(4,5-dihydro-1H-imidazol-2-ylamino)phenyl]-3-oxo-2-phenoxy-4-pentenoic acid IUPAC Name: (E)-5-[2-(4,5-dihydro-1H-imidazol-2-ylamino)phenyl]-3-oxo-2-phenoxypent-4-enoic acid Traditional Name: (E)-5-[2-(2-imidazolin-2-ylamino)phenyl]-3-keto-2-phenoxy-pent-4-enoic acid Formula: C20H19N3O4 MolecularWeight: 365.38256

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Descriptors Computed from Structure

Canonical SMILES:

C1CN=C(N1)NC2=CC=CC=C2C=CC(=O)C(C(=O)O)OC3=CC=CC=C3

Isomeric SMILES

C1CN=C(N1)NC2=CC=CC=C2/C=C/C(=O)C(C(=O)O)OC3=CC=CC=C3

InChI

InChI=1S/C20H19N3O4/c24-17(18(19(25)26)27-15-7-2-1-3-8-15)11-10-14-6-4-5-9-16(14)23-20-21-12-13-22-20/h1-11,18H,12-13H2,(H,25,26)(H2,21,22,23)/b11-10+