(Z)-4-(cyclohexylazaniumyl)-2,3-dimethyl-but-2-ene-1-sulfonate

Systemtic Name: (Z)-4-(cyclohexylazaniumyl)-2,3-dimethyl-but-2-ene-1-sulfonate Openeye Name: (Z)-4-(cyclohexylammonio)-2,3-dimethyl-but-2-ene-1-sulfonate CAS Name: (Z)-4-(cyclohexylammonio)-2,3-dimethyl-2-butene-1-sulfonate IUPAC Name: (Z)-4-(cyclohexylazaniumyl)-2,3-dimethylbut-2-ene-1-sulfonate Traditional Name: (Z)-4-(cyclohexylammonio)-2,3-dimethyl-but-2-ene-1-sulfonate Formula: C12H23NO3S MolecularWeight: 261.38092

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C(C)CS(=O)(=O)[O-])C[NH2+]C1CCCCC1

Isomeric SMILES

C/C(=C(\C)/CS(=O)(=O)[O-])/C[NH2+]C1CCCCC1

InChI

InChI=1S/C12H23NO3S/c1-10(11(2)9-17(14,15)16)8-13-12-6-4-3-5-7-12/h12-13H,3-9H2,1-2H3,(H,14,15,16)/b11-10-