[4-[(3,4-dimethylphenyl)sulfonyl-methyl-amino]phenyl] 2-methylfuran-3-carboxylate

Systemtic Name: [4-[(3,4-dimethylphenyl)sulfonyl-methyl-amino]phenyl] 2-methylfuran-3-carboxylate Openeye Name: [4-[(3,4-dimethylphenyl)sulfonyl-methyl-amino]phenyl] 2-methylfuran-3-carboxylate CAS Name: 2-methyl-3-furancarboxylic acid [4-[(3,4-dimethylphenyl)sulfonyl-methylamino]phenyl] ester IUPAC Name: [4-[(3,4-dimethylphenyl)sulfonyl-methylamino]phenyl] 2-methylfuran-3-carboxylate Traditional Name: 2-methylfuran-3-carboxylic acid [4-[(3,4-dimethylphenyl)sulfonyl-methyl-amino]phenyl] ester Formula: C21H21NO5S MolecularWeight: 399.46014

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N(C)C2=CC=C(C=C2)OC(=O)C3=C(OC=C3)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N(C)C2=CC=C(C=C2)OC(=O)C3=C(OC=C3)C)C

InChI

InChI=1S/C21H21NO5S/c1-14-5-10-19(13-15(14)2)28(24,25)22(4)17-6-8-18(9-7-17)27-21(23)20-11-12-26-16(20)3/h5-13H,1-4H3