ethyl 4-[[[3-(4-fluorophenyl)sulfonyloxyphenyl]methyl-propan-2-yl-carbamoyl]amino]benzoate

Systemtic Name: ethyl 4-[[[3-(4-fluorophenyl)sulfonyloxyphenyl]methyl-propan-2-yl-carbamoyl]amino]benzoate Openeye Name: ethyl 4-[[[3-(4-fluorophenyl)sulfonyloxyphenyl]methyl-isopropyl-carbamoyl]amino]benzoate CAS Name: 4-[[[[3-(4-fluorophenyl)sulfonyloxyphenyl]methyl-propan-2-ylamino]-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[[3-(4-fluorophenyl)sulfonyloxyphenyl]methyl-propan-2-ylcarbamoyl]amino]benzoate Traditional Name: 4-[[[3-(4-fluorophenyl)sulfonyloxybenzyl]-isopropyl-carbamoyl]amino]benzoic acid ethyl ester Formula: C26H27FN2O6S MolecularWeight: 514.565783

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)N(CC2=CC(=CC=C2)OS(=O)(=O)C3=CC=C(C=C3)F)C(C)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)N(CC2=CC(=CC=C2)OS(=O)(=O)C3=CC=C(C=C3)F)C(C)C

InChI

InChI=1S/C26H27FN2O6S/c1-4-34-25(30)20-8-12-22(13-9-20)28-26(31)29(18(2)3)17-19-6-5-7-23(16-19)35-36(32,33)24-14-10-21(27)11-15-24/h5-16,18H,4,17H2,1-3H3,(H,28,31)