1-(4-ethylpiperazin-4-ium-1-yl)-3-(1-phenylbenzimidazol-2-yl)propan-1-one

Systemtic Name: 1-(4-ethylpiperazin-4-ium-1-yl)-3-(1-phenylbenzimidazol-2-yl)propan-1-one Openeye Name: 1-(4-ethylpiperazin-4-ium-1-yl)-3-(1-phenylbenzimidazol-2-yl)propan-1-one CAS Name: 1-(4-ethyl-1-piperazin-4-iumyl)-3-(1-phenyl-2-benzimidazolyl)-1-propanone IUPAC Name: 1-(4-ethylpiperazin-4-ium-1-yl)-3-(1-phenylbenzimidazol-2-yl)propan-1-one Traditional Name: 1-(4-ethylpiperazin-4-ium-1-yl)-3-(1-phenylbenzimidazol-2-yl)propan-1-one Formula: C22H27N4O+ MolecularWeight: 363.47598

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C(=O)CCC2=NC3=CC=CC=C3N2C4=CC=CC=C4

Isomeric SMILES

CC[NH+]1CCN(CC1)C(=O)CCC2=NC3=CC=CC=C3N2C4=CC=CC=C4

InChI

InChI=1S/C22H26N4O/c1-2-24-14-16-25(17-15-24)22(27)13-12-21-23-19-10-6-7-11-20(19)26(21)18-8-4-3-5-9-18/h3-11H,2,12-17H2,1H3/p+1