(6-chloranyl-1H-benzimidazol-2-yl)methyl-methyl-[(3-phenethyl-1,2,4-oxadiazol-5-yl)methyl]azanium

Systemtic Name: (6-chloranyl-1H-benzimidazol-2-yl)methyl-methyl-[(3-phenethyl-1,2,4-oxadiazol-5-yl)methyl]azanium Openeye Name: (6-chloro-1H-benzimidazol-2-yl)methyl-methyl-[(3-phenethyl-1,2,4-oxadiazol-5-yl)methyl]ammonium CAS Name: (6-chloro-1H-benzimidazol-2-yl)methyl-methyl-[(3-phenethyl-1,2,4-oxadiazol-5-yl)methyl]ammonium IUPAC Name: (6-chloro-1H-benzimidazol-2-yl)methyl-methyl-[(3-phenethyl-1,2,4-oxadiazol-5-yl)methyl]azanium Traditional Name: (6-chloro-1H-benzimidazol-2-yl)methyl-methyl-[(3-phenethyl-1,2,4-oxadiazol-5-yl)methyl]ammonium Formula: C20H21ClN5O+ MolecularWeight: 382.86664

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=NC2=C(N1)C=C(C=C2)Cl)CC3=NC(=NO3)CCC4=CC=CC=C4

Isomeric SMILES

C[NH+](CC1=NC2=C(N1)C=C(C=C2)Cl)CC3=NC(=NO3)CCC4=CC=CC=C4

InChI

InChI=1S/C20H20ClN5O/c1-26(12-19-22-16-9-8-15(21)11-17(16)23-19)13-20-24-18(25-27-20)10-7-14-5-3-2-4-6-14/h2-6,8-9,11H,7,10,12-13H2,1H3,(H,22,23)/p+1