[(1S)-1-[5,6-dimethyl-1-(2-piperidin-1-ium-1-ylethyl)benzimidazol-2-yl]ethyl]azanium

Systemtic Name: [(1S)-1-[5,6-dimethyl-1-(2-piperidin-1-ium-1-ylethyl)benzimidazol-2-yl]ethyl]azanium Openeye Name: [(1S)-1-[5,6-dimethyl-1-(2-piperidin-1-ium-1-ylethyl)benzimidazol-2-yl]ethyl]ammonium CAS Name: [(1S)-1-[5,6-dimethyl-1-[2-(1-piperidin-1-iumyl)ethyl]-2-benzimidazolyl]ethyl]ammonium IUPAC Name: [(1S)-1-[5,6-dimethyl-1-(2-piperidin-1-ium-1-ylethyl)benzimidazol-2-yl]ethyl]azanium Traditional Name: [(1S)-1-[5,6-dimethyl-1-(2-piperidin-1-ium-1-ylethyl)benzimidazol-2-yl]ethyl]ammonium Formula: C18H30N4+2 MolecularWeight: 302.4576

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)N(C(=N2)C(C)[NH3+])CC[NH+]3CCCCC3

Isomeric SMILES

CC1=CC2=C(C=C1C)N(C(=N2)[C@H](C)[NH3+])CC[NH+]3CCCCC3

InChI

InChI=1S/C18H28N4/c1-13-11-16-17(12-14(13)2)22(18(20-16)15(3)19)10-9-21-7-5-4-6-8-21/h11-12,15H,4-10,19H2,1-3H3/p+2/t15-/m0/s1