potassium 4-(butylcarbamoylamino)-3-methoxy-benzenesulfonic acid

Systemtic Name: potassium 4-(butylcarbamoylamino)-3-methoxy-benzenesulfonic acid Openeye Name: potassium 4-(butylcarbamoylamino)-3-methoxy-benzenesulfonic acid CAS Name: potassium 4-[[butylamino(oxo)methyl]amino]-3-methoxybenzenesulfonic acid IUPAC Name: potassium 4-(butylcarbamoylamino)-3-methoxybenzenesulfonic acid Traditional Name: potassium 4-(butylcarbamoylamino)-3-methoxy-besylic acid Formula: C12H18KN2O5S+ MolecularWeight: 341.44502

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)NC1=C(C=C(C=C1)S(=O)(=O)O)OC.[K+]

Isomeric SMILES

CCCCNC(=O)NC1=C(C=C(C=C1)S(=O)(=O)O)OC.[K+]

InChI

InChI=1S/C12H18N2O5S.K/c1-3-4-7-13-12(15)14-10-6-5-9(20(16,17)18)8-11(10)19-2;/h5-6,8H,3-4,7H2,1-2H3,(H2,13,14,15)(H,16,17,18);/q;+1