10-[3-[(2S)-2,3-bis(oxidanyl)propyl]-1H-benzimidazol-3-ium-2-yl]decylazanium

Systemtic Name: 10-[3-[(2S)-2,3-bis(oxidanyl)propyl]-1H-benzimidazol-3-ium-2-yl]decylazanium Openeye Name: 10-[3-[(2S)-2,3-dihydroxypropyl]-1H-benzimidazol-3-ium-2-yl]decylammonium CAS Name: 10-[3-[(2S)-2,3-dihydroxypropyl]-1H-benzimidazol-3-ium-2-yl]decylammonium IUPAC Name: 10-[3-[(2S)-2,3-dihydroxypropyl]-1H-benzimidazol-3-ium-2-yl]decylazanium Traditional Name: 10-[3-[(2S)-2,3-dihydroxypropyl]-1H-benzimidazol-3-ium-2-yl]decylammonium Formula: C20H35N3O2+2 MolecularWeight: 349.5108

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=[N+]2CC(CO)O)CCCCCCCCCC[NH3+]

Isomeric SMILES

C1=CC=C2C(=C1)NC(=[N+]2C[C@@H](CO)O)CCCCCCCCCC[NH3+]

InChI

InChI=1S/C20H33N3O2/c21-14-10-6-4-2-1-3-5-7-13-20-22-18-11-8-9-12-19(18)23(20)15-17(25)16-24/h8-9,11-12,17,24-25H,1-7,10,13-16,21H2/p+2/t17-/m0/s1