[(4-butoxyphenyl)-methyl-amino]methanesulfonic acid

Systemtic Name: [(4-butoxyphenyl)-methyl-amino]methanesulfonic acid Openeye Name: (4-butoxy-N-methyl-anilino)methanesulfonic acid CAS Name: (4-butoxy-N-methylanilino)methanesulfonic acid IUPAC Name: (4-butoxy-N-methylanilino)methanesulfonic acid Traditional Name: (4-butoxy-N-methyl-anilino)methanesulfonic acid Formula: C12H19NO4S MolecularWeight: 273.34856

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)N(C)CS(=O)(=O)O

Isomeric SMILES

CCCCOC1=CC=C(C=C1)N(C)CS(=O)(=O)O

InChI

InChI=1S/C12H19NO4S/c1-3-4-9-17-12-7-5-11(6-8-12)13(2)10-18(14,15)16/h5-8H,3-4,9-10H2,1-2H3,(H,14,15,16)