[3-[(2-methylbenzimidazol-1-yl)methyl]phenyl]-piperazin-4-ium-1-yl-methanone

Systemtic Name: [3-[(2-methylbenzimidazol-1-yl)methyl]phenyl]-piperazin-4-ium-1-yl-methanone Openeye Name: [3-[(2-methylbenzimidazol-1-yl)methyl]phenyl]-piperazin-4-ium-1-yl-methanone CAS Name: [3-[(2-methyl-1-benzimidazolyl)methyl]phenyl]-(1-piperazin-4-iumyl)methanone IUPAC Name: [3-[(2-methylbenzimidazol-1-yl)methyl]phenyl]-piperazin-4-ium-1-ylmethanone Traditional Name: [3-[(2-methylbenzimidazol-1-yl)methyl]phenyl]-piperazin-4-ium-1-yl-methanone Formula: C20H23N4O+ MolecularWeight: 335.42282

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2N1CC3=CC=CC(=C3)C(=O)N4CC[NH2+]CC4

Isomeric SMILES

CC1=NC2=CC=CC=C2N1CC3=CC=CC(=C3)C(=O)N4CC[NH2+]CC4

InChI

InChI=1S/C20H22N4O/c1-15-22-18-7-2-3-8-19(18)24(15)14-16-5-4-6-17(13-16)20(25)23-11-9-21-10-12-23/h2-8,13,21H,9-12,14H2,1H3/p+1