1-[2-azanyl-3-[3-(dimethylamino)propyl]-7-methyl-benzimidazol-1-ium-1-yl]-2,2-dimethyl-propan-1-one

Systemtic Name: 1-[2-azanyl-3-[3-(dimethylamino)propyl]-7-methyl-benzimidazol-1-ium-1-yl]-2,2-dimethyl-propan-1-one Openeye Name: 1-[2-amino-3-[3-(dimethylamino)propyl]-7-methyl-benzimidazol-1-ium-1-yl]-2,2-dimethyl-propan-1-one CAS Name: 1-[2-amino-3-[3-(dimethylamino)propyl]-7-methyl-1-benzimidazol-1-iumyl]-2,2-dimethyl-1-propanone IUPAC Name: 1-[2-amino-3-[3-(dimethylamino)propyl]-7-methylbenzimidazol-1-ium-1-yl]-2,2-dimethylpropan-1-one Traditional Name: 1-[2-amino-3-[3-(dimethylamino)propyl]-7-methyl-benzimidazol-1-ium-1-yl]-2,2-dimethyl-propan-1-one Formula: C18H29N4O+ MolecularWeight: 317.44906

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)N(C(=[N+]2C(=O)C(C)(C)C)N)CCCN(C)C

Isomeric SMILES

CC1=C2C(=CC=C1)N(C(=[N+]2C(=O)C(C)(C)C)N)CCCN(C)C

InChI

InChI=1S/C18H28N4O/c1-13-9-7-10-14-15(13)22(16(23)18(2,3)4)17(19)21(14)12-8-11-20(5)6/h7,9-10,19H,8,11-12H2,1-6H3/p+1