1-[[2-cyclopentylsulfonyl-3-(3-methoxypropyl)imidazol-4-yl]methyl]azocan-1-ium

Systemtic Name: 1-[[2-cyclopentylsulfonyl-3-(3-methoxypropyl)imidazol-4-yl]methyl]azocan-1-ium Openeye Name: 1-[[2-cyclopentylsulfonyl-3-(3-methoxypropyl)imidazol-4-yl]methyl]azocan-1-ium CAS Name: 1-[[2-cyclopentylsulfonyl-3-(3-methoxypropyl)-4-imidazolyl]methyl]azocan-1-ium IUPAC Name: 1-[[2-cyclopentylsulfonyl-3-(3-methoxypropyl)imidazol-4-yl]methyl]azocan-1-ium Traditional Name: 1-[[2-cyclopentylsulfonyl-3-(3-methoxypropyl)imidazol-4-yl]methyl]azocan-1-ium Formula: C20H36N3O3S+ MolecularWeight: 398.58314

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Descriptors Computed from Structure

Canonical SMILES:

COCCCN1C(=CN=C1S(=O)(=O)C2CCCC2)C[NH+]3CCCCCCC3

Isomeric SMILES

COCCCN1C(=CN=C1S(=O)(=O)C2CCCC2)C[NH+]3CCCCCCC3

InChI

InChI=1S/C20H35N3O3S/c1-26-15-9-14-23-18(17-22-12-7-3-2-4-8-13-22)16-21-20(23)27(24,25)19-10-5-6-11-19/h16,19H,2-15,17H2,1H3/p+1