[2-[1-[[6-(4-chlorophenyl)sulfonyl-3,6-bis(fluoranyl)cyclohexa-2,4-dien-1-yl]amino]ethyl]phenyl]methyl morpholine-4-carboxylate

Systemtic Name: [2-[1-[[6-(4-chlorophenyl)sulfonyl-3,6-bis(fluoranyl)cyclohexa-2,4-dien-1-yl]amino]ethyl]phenyl]methyl morpholine-4-carboxylate Openeye Name: [2-[1-[[6-(4-chlorophenyl)sulfonyl-3,6-difluoro-cyclohexa-2,4-dien-1-yl]amino]ethyl]phenyl]methyl morpholine-4-carboxylate CAS Name: 4-morpholinecarboxylic acid [2-[1-[[6-(4-chlorophenyl)sulfonyl-3,6-difluoro-1-cyclohexa-2,4-dienyl]amino]ethyl]phenyl]methyl ester IUPAC Name: [2-[1-[[6-(4-chlorophenyl)sulfonyl-3,6-difluorocyclohexa-2,4-dien-1-yl]amino]ethyl]phenyl]methyl morpholine-4-carboxylate Traditional Name: morpholine-4-carboxylic acid [2-[1-[[6-(4-chlorophenyl)sulfonyl-3,6-difluoro-cyclohexa-2,4-dien-1-yl]amino]ethyl]benzyl] ester Formula: C26H27ClF2N2O5S MolecularWeight: 553.017786

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1COC(=O)N2CCOCC2)NC3C=C(C=CC3(F)S(=O)(=O)C4=CC=C(C=C4)Cl)F

Isomeric SMILES

CC(C1=CC=CC=C1COC(=O)N2CCOCC2)NC3C=C(C=CC3(F)S(=O)(=O)C4=CC=C(C=C4)Cl)F

InChI

InChI=1S/C26H27ClF2N2O5S/c1-18(23-5-3-2-4-19(23)17-36-25(32)31-12-14-35-15-13-31)30-24-16-21(28)10-11-26(24,29)37(33,34)22-8-6-20(27)7-9-22/h2-11,16,18,24,30H,12-15,17H2,1H3