[4-(ethylamino)-2-methyl-3-propyl-phenyl]-methylsulfonyl-sulfamic acid

Systemtic Name: [4-(ethylamino)-2-methyl-3-propyl-phenyl]-methylsulfonyl-sulfamic acid Openeye Name: [4-(ethylamino)-2-methyl-3-propyl-phenyl]-methylsulfonyl-sulfamic acid CAS Name: [4-(ethylamino)-2-methyl-3-propylphenyl]-methylsulfonylsulfamic acid IUPAC Name: [4-(ethylamino)-2-methyl-3-propylphenyl]-methylsulfonylsulfamic acid Traditional Name: [4-(ethylamino)-2-methyl-3-propyl-phenyl]-mesyl-sulfamic acid Formula: C13H22N2O5S2 MolecularWeight: 350.45418

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1C)N(S(=O)(=O)C)S(=O)(=O)O)NCC

Isomeric SMILES

CCCC1=C(C=CC(=C1C)N(S(=O)(=O)C)S(=O)(=O)O)NCC

InChI

InChI=1S/C13H22N2O5S2/c1-5-7-11-10(3)13(9-8-12(11)14-6-2)15(21(4,16)17)22(18,19)20/h8-9,14H,5-7H2,1-4H3,(H,18,19,20)