(3R,4R)-1-[(1-methylbenzimidazol-2-yl)methyl]-4-(4-methylpiperazin-4-ium-1-yl)piperidin-1-ium-3-ol

Systemtic Name: (3R,4R)-1-[(1-methylbenzimidazol-2-yl)methyl]-4-(4-methylpiperazin-4-ium-1-yl)piperidin-1-ium-3-ol Openeye Name: (3R,4R)-1-[(1-methylbenzimidazol-2-yl)methyl]-4-(4-methylpiperazin-4-ium-1-yl)piperidin-1-ium-3-ol CAS Name: (3R,4R)-1-[(1-methyl-2-benzimidazolyl)methyl]-4-(4-methyl-1-piperazin-4-iumyl)-3-piperidin-1-iumol IUPAC Name: (3R,4R)-1-[(1-methylbenzimidazol-2-yl)methyl]-4-(4-methylpiperazin-4-ium-1-yl)piperidin-1-ium-3-ol Traditional Name: (3R,4R)-1-[(1-methylbenzimidazol-2-yl)methyl]-4-(4-methylpiperazin-4-ium-1-yl)piperidin-1-ium-3-ol Formula: C19H31N5O+2 MolecularWeight: 345.48234

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2CC[NH+](CC2O)CC3=NC4=CC=CC=C4N3C

Isomeric SMILES

C[NH+]1CCN(CC1)[C@@H]2CC[NH+](C[C@H]2O)CC3=NC4=CC=CC=C4N3C

InChI

InChI=1S/C19H29N5O/c1-21-9-11-24(12-10-21)17-7-8-23(13-18(17)25)14-19-20-15-5-3-4-6-16(15)22(19)2/h3-6,17-18,25H,7-14H2,1-2H3/p+2/t17-,18-/m1/s1