bis[4-(4,5-dihydro-1H-imidazol-3-ium-2-ylamino)phenyl]methanone

Systemtic Name: bis[4-(4,5-dihydro-1H-imidazol-3-ium-2-ylamino)phenyl]methanone Openeye Name: bis[4-(4,5-dihydro-1H-imidazol-3-ium-2-ylamino)phenyl]methanone CAS Name: bis[4-(4,5-dihydro-1H-imidazol-3-ium-2-ylamino)phenyl]methanone IUPAC Name: bis[4-(4,5-dihydro-1H-imidazol-3-ium-2-ylamino)phenyl]methanone Traditional Name: bis[4-(2-imidazolin-1-ium-2-ylamino)phenyl]methanone Formula: C19H22N6O+2 MolecularWeight: 350.41758

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+]=C(N1)NC2=CC=C(C=C2)C(=O)C3=CC=C(C=C3)NC4=[NH+]CCN4

Isomeric SMILES

C1C[NH+]=C(N1)NC2=CC=C(C=C2)C(=O)C3=CC=C(C=C3)NC4=[NH+]CCN4

InChI

InChI=1S/C19H20N6O/c26-17(13-1-5-15(6-2-13)24-18-20-9-10-21-18)14-3-7-16(8-4-14)25-19-22-11-12-23-19/h1-8H,9-12H2,(H2,20,21,24)(H2,22,23,25)/p+2