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

Systemtic Name: (3S)-1-[[3-butyl-2-(cyclobutylmethylsulfonyl)imidazol-4-yl]methyl]-3-methoxy-piperidin-1-ium Openeye Name: (3S)-1-[[3-butyl-2-(cyclobutylmethylsulfonyl)imidazol-4-yl]methyl]-3-methoxy-piperidin-1-ium CAS Name: (3S)-1-[[3-butyl-2-(cyclobutylmethylsulfonyl)-4-imidazolyl]methyl]-3-methoxypiperidin-1-ium IUPAC Name: (3S)-1-[[3-butyl-2-(cyclobutylmethylsulfonyl)imidazol-4-yl]methyl]-3-methoxypiperidin-1-ium Traditional Name: (3S)-1-[[3-butyl-2-(cyclobutylmethylsulfonyl)imidazol-4-yl]methyl]-3-methoxy-piperidin-1-ium Formula: C19H34N3O3S+ MolecularWeight: 384.55656

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=CN=C1S(=O)(=O)CC2CCC2)C[NH+]3CCCC(C3)OC

Isomeric SMILES

CCCCN1C(=CN=C1S(=O)(=O)CC2CCC2)C[NH+]3CCC[C@@H](C3)OC

InChI

InChI=1S/C19H33N3O3S/c1-3-4-11-22-17(13-21-10-6-9-18(14-21)25-2)12-20-19(22)26(23,24)15-16-7-5-8-16/h12,16,18H,3-11,13-15H2,1-2H3/p+1/t18-/m0/s1