[2-(methylsulfonylamino)-4-[(4-octylphenyl)carbamoyloxymethyl]phenyl] 2,2-dimethylpropanoate

Systemtic Name: [2-(methylsulfonylamino)-4-[(4-octylphenyl)carbamoyloxymethyl]phenyl] 2,2-dimethylpropanoate Openeye Name: [2-(methanesulfonamido)-4-[(4-octylphenyl)carbamoyloxymethyl]phenyl] 2,2-dimethylpropanoate CAS Name: 2,2-dimethylpropanoic acid [2-(methanesulfonamido)-4-[[(4-octylanilino)-oxomethoxy]methyl]phenyl] ester IUPAC Name: [2-(methanesulfonamido)-4-[(4-octylphenyl)carbamoyloxymethyl]phenyl] 2,2-dimethylpropanoate Traditional Name: 2,2-dimethylpropionic acid [2-(methanesulfonamido)-4-[(4-octylphenyl)carbamoyloxymethyl]phenyl] ester Formula: C28H40N2O6S MolecularWeight: 532.692

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=C(C=C1)NC(=O)OCC2=CC(=C(C=C2)OC(=O)C(C)(C)C)NS(=O)(=O)C

Isomeric SMILES

CCCCCCCCC1=CC=C(C=C1)NC(=O)OCC2=CC(=C(C=C2)OC(=O)C(C)(C)C)NS(=O)(=O)C

InChI

InChI=1S/C28H40N2O6S/c1-6-7-8-9-10-11-12-21-13-16-23(17-14-21)29-27(32)35-20-22-15-18-25(36-26(31)28(2,3)4)24(19-22)30-37(5,33)34/h13-19,30H,6-12,20H2,1-5H3,(H,29,32)