5-methyl-4-[(4-methylphenyl)sulfonylamino]-2-propan-2-yl-phenolate

Systemtic Name: 5-methyl-4-[(4-methylphenyl)sulfonylamino]-2-propan-2-yl-phenolate Openeye Name: 2-isopropyl-5-methyl-4-(p-tolylsulfonylamino)phenolate CAS Name: 5-methyl-4-[(4-methylphenyl)sulfonylamino]-2-propan-2-ylphenolate IUPAC Name: 5-methyl-4-[(4-methylphenyl)sulfonylamino]-2-propan-2-ylphenolate Traditional Name: 2-isopropyl-5-methyl-4-(tosylamino)phenolate Formula: C17H20NO3S- MolecularWeight: 318.4106

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2=C(C=C(C(=C2)C(C)C)[O-])C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2=C(C=C(C(=C2)C(C)C)[O-])C

InChI

InChI=1S/C17H21NO3S/c1-11(2)15-10-16(13(4)9-17(15)19)18-22(20,21)14-7-5-12(3)6-8-14/h5-11,18-19H,1-4H3/p-1