[4-[(3,4-dimethylphenyl)sulfonyl-methyl-amino]phenyl] 2-(3-fluorophenyl)ethanoate

Systemtic Name: [4-[(3,4-dimethylphenyl)sulfonyl-methyl-amino]phenyl] 2-(3-fluorophenyl)ethanoate Openeye Name: [4-[(3,4-dimethylphenyl)sulfonyl-methyl-amino]phenyl] 2-(3-fluorophenyl)acetate CAS Name: 2-(3-fluorophenyl)acetic acid [4-[(3,4-dimethylphenyl)sulfonyl-methylamino]phenyl] ester IUPAC Name: [4-[(3,4-dimethylphenyl)sulfonyl-methylamino]phenyl] 2-(3-fluorophenyl)acetate Traditional Name: 2-(3-fluorophenyl)acetic acid [4-[(3,4-dimethylphenyl)sulfonyl-methyl-amino]phenyl] ester Formula: C23H22FNO4S MolecularWeight: 427.488483

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)CC3=CC(=CC=C3)F)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N(C)C2=CC=C(C=C2)OC(=O)CC3=CC(=CC=C3)F)C

InChI

InChI=1S/C23H22FNO4S/c1-16-7-12-22(13-17(16)2)30(27,28)25(3)20-8-10-21(11-9-20)29-23(26)15-18-5-4-6-19(24)14-18/h4-14H,15H2,1-3H3