(3S)-1-[[2-cycloheptylsulfonyl-3-(2-methoxyethyl)imidazol-4-yl]methyl]-3-methoxy-piperidin-1-ium

Systemtic Name: (3S)-1-[[2-cycloheptylsulfonyl-3-(2-methoxyethyl)imidazol-4-yl]methyl]-3-methoxy-piperidin-1-ium Openeye Name: (3S)-1-[[2-cycloheptylsulfonyl-3-(2-methoxyethyl)imidazol-4-yl]methyl]-3-methoxy-piperidin-1-ium CAS Name: (3S)-1-[[2-cycloheptylsulfonyl-3-(2-methoxyethyl)-4-imidazolyl]methyl]-3-methoxypiperidin-1-ium IUPAC Name: (3S)-1-[[2-cycloheptylsulfonyl-3-(2-methoxyethyl)imidazol-4-yl]methyl]-3-methoxypiperidin-1-ium Traditional Name: (3S)-1-[[2-cycloheptylsulfonyl-3-(2-methoxyethyl)imidazol-4-yl]methyl]-3-methoxy-piperidin-1-ium Formula: C20H36N3O4S+ MolecularWeight: 414.58254

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Descriptors Computed from Structure

Canonical SMILES:

COCCN1C(=CN=C1S(=O)(=O)C2CCCCCC2)C[NH+]3CCCC(C3)OC

Isomeric SMILES

COCCN1C(=CN=C1S(=O)(=O)C2CCCCCC2)C[NH+]3CCC[C@@H](C3)OC

InChI

InChI=1S/C20H35N3O4S/c1-26-13-12-23-17(15-22-11-7-8-18(16-22)27-2)14-21-20(23)28(24,25)19-9-5-3-4-6-10-19/h14,18-19H,3-13,15-16H2,1-2H3/p+1/t18-/m0/s1