(6S)-10-[(3-butyl-2-ethylsulfonyl-imidazol-4-yl)methyl]-4-methyl-4,10-diazoniaspiro[5.5]undecane

Systemtic Name: (6S)-10-[(3-butyl-2-ethylsulfonyl-imidazol-4-yl)methyl]-4-methyl-4,10-diazoniaspiro[5.5]undecane Openeye Name: (6S)-10-[(3-butyl-2-ethylsulfonyl-imidazol-4-yl)methyl]-4-methyl-4,10-diazoniaspiro[5.5]undecane CAS Name: (6S)-10-[(3-butyl-2-ethylsulfonyl-4-imidazolyl)methyl]-4-methyl-4,10-diazoniaspiro[5.5]undecane IUPAC Name: (6S)-10-[(3-butyl-2-ethylsulfonylimidazol-4-yl)methyl]-4-methyl-4,10-diazoniaspiro[5.5]undecane Traditional Name: (6S)-10-[(3-butyl-2-esyl-imidazol-4-yl)methyl]-4-methyl-4,10-diazoniaspiro[5.5]undecane Formula: C20H38N4O2S+2 MolecularWeight: 398.60632

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=CN=C1S(=O)(=O)CC)C[NH+]2CCCC3(C2)CCC[NH+](C3)C

Isomeric SMILES

CCCCN1C(=CN=C1S(=O)(=O)CC)C[NH+]2CCC[C@@]3(C2)CCC[NH+](C3)C

InChI

InChI=1S/C20H36N4O2S/c1-4-6-13-24-18(14-21-19(24)27(25,26)5-2)15-23-12-8-10-20(17-23)9-7-11-22(3)16-20/h14H,4-13,15-17H2,1-3H3/p+2/t20-/m0/s1