[(2S)-2-oxidanyl-3-[2-(phenylmethyl)benzimidazol-1-yl]propyl]-bis(prop-2-enyl)azanium

Systemtic Name: [(2S)-2-oxidanyl-3-[2-(phenylmethyl)benzimidazol-1-yl]propyl]-bis(prop-2-enyl)azanium Openeye Name: diallyl-[(2S)-3-(2-benzylbenzimidazol-1-yl)-2-hydroxy-propyl]ammonium CAS Name: [(2S)-2-hydroxy-3-[2-(phenylmethyl)-1-benzimidazolyl]propyl]-bis(prop-2-enyl)ammonium IUPAC Name: [(2S)-3-(2-benzylbenzimidazol-1-yl)-2-hydroxypropyl]-bis(prop-2-enyl)azanium Traditional Name: diallyl-[(2S)-3-(2-benzylbenzimidazol-1-yl)-2-hydroxy-propyl]ammonium Formula: C23H28N3O+ MolecularWeight: 362.48792

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Descriptors Computed from Structure

Canonical SMILES:

C=CC[NH+](CC=C)CC(CN1C2=CC=CC=C2N=C1CC3=CC=CC=C3)O

Isomeric SMILES

C=CC[NH+](CC=C)C[C@H](CN1C2=CC=CC=C2N=C1CC3=CC=CC=C3)O

InChI

InChI=1S/C23H27N3O/c1-3-14-25(15-4-2)17-20(27)18-26-22-13-9-8-12-21(22)24-23(26)16-19-10-6-5-7-11-19/h3-13,20,27H,1-2,14-18H2/p+1/t20-/m1/s1