3-(benzimidazol-1-yl)propyl-[(2S)-5-methylhexan-2-yl]azanium

Systemtic Name: 3-(benzimidazol-1-yl)propyl-[(2S)-5-methylhexan-2-yl]azanium Openeye Name: 3-(benzimidazol-1-yl)propyl-[(1S)-1,4-dimethylpentyl]ammonium CAS Name: 3-(1-benzimidazolyl)propyl-[(2S)-5-methylhexan-2-yl]ammonium IUPAC Name: 3-(benzimidazol-1-yl)propyl-[(2S)-5-methylhexan-2-yl]azanium Traditional Name: 3-(benzimidazol-1-yl)propyl-[(1S)-1,4-dimethylpentyl]ammonium Formula: C17H28N3+ MolecularWeight: 274.42432

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(C)[NH2+]CCCN1C=NC2=CC=CC=C21

Isomeric SMILES

C[C@@H](CCC(C)C)[NH2+]CCCN1C=NC2=CC=CC=C21

InChI

InChI=1S/C17H27N3/c1-14(2)9-10-15(3)18-11-6-12-20-13-19-16-7-4-5-8-17(16)20/h4-5,7-8,13-15,18H,6,9-12H2,1-3H3/p+1/t15-/m0/s1