[1-[(4-methoxyphenyl)amino]-3-methyl-1-oxidanylidene-butan-2-yl] 2-methyl-5-methylsulfonyl-benzoate

Systemtic Name: [1-[(4-methoxyphenyl)amino]-3-methyl-1-oxidanylidene-butan-2-yl] 2-methyl-5-methylsulfonyl-benzoate Openeye Name: [1-[(4-methoxyphenyl)carbamoyl]-2-methyl-propyl] 2-methyl-5-methylsulfonyl-benzoate CAS Name: 2-methyl-5-methylsulfonylbenzoic acid [1-(4-methoxyanilino)-3-methyl-1-oxobutan-2-yl] ester IUPAC Name: [1-(4-methoxyanilino)-3-methyl-1-oxobutan-2-yl] 2-methyl-5-methylsulfonylbenzoate Traditional Name: 5-mesyl-2-methyl-benzoic acid [1-[(4-methoxyphenyl)carbamoyl]-2-methyl-propyl] ester Formula: C21H25NO6S MolecularWeight: 419.4913

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)C)C(=O)OC(C(C)C)C(=O)NC2=CC=C(C=C2)OC

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)C)C(=O)OC(C(C)C)C(=O)NC2=CC=C(C=C2)OC

InChI

InChI=1S/C21H25NO6S/c1-13(2)19(20(23)22-15-7-9-16(27-4)10-8-15)28-21(24)18-12-17(29(5,25)26)11-6-14(18)3/h6-13,19H,1-5H3,(H,22,23)