(3-chlorophenyl)-[(3S)-1-[(1-ethylbenzimidazol-2-yl)methyl]piperidin-1-ium-3-yl]methanone

Systemtic Name: (3-chlorophenyl)-[(3S)-1-[(1-ethylbenzimidazol-2-yl)methyl]piperidin-1-ium-3-yl]methanone Openeye Name: (3-chlorophenyl)-[(3S)-1-[(1-ethylbenzimidazol-2-yl)methyl]piperidin-1-ium-3-yl]methanone CAS Name: (3-chlorophenyl)-[(3S)-1-[(1-ethyl-2-benzimidazolyl)methyl]-3-piperidin-1-iumyl]methanone IUPAC Name: (3-chlorophenyl)-[(3S)-1-[(1-ethylbenzimidazol-2-yl)methyl]piperidin-1-ium-3-yl]methanone Traditional Name: (3-chlorophenyl)-[(3S)-1-[(1-ethylbenzimidazol-2-yl)methyl]piperidin-1-ium-3-yl]methanone Formula: C22H25ClN3O+ MolecularWeight: 382.9064

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2N=C1C[NH+]3CCCC(C3)C(=O)C4=CC(=CC=C4)Cl

Isomeric SMILES

CCN1C2=CC=CC=C2N=C1C[NH+]3CCC[C@@H](C3)C(=O)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C22H24ClN3O/c1-2-26-20-11-4-3-10-19(20)24-21(26)15-25-12-6-8-17(14-25)22(27)16-7-5-9-18(23)13-16/h3-5,7,9-11,13,17H,2,6,8,12,14-15H2,1H3/p+1/t17-/m0/s1