[4-[[butan-2-yl(ethanoyl)amino]methyl]phenyl] 4-methoxybenzenesulfonate

Systemtic Name: [4-[[butan-2-yl(ethanoyl)amino]methyl]phenyl] 4-methoxybenzenesulfonate Openeye Name: [4-[[acetyl(sec-butyl)amino]methyl]phenyl] 4-methoxybenzenesulfonate CAS Name: 4-methoxybenzenesulfonic acid [4-[[acetyl(butan-2-yl)amino]methyl]phenyl] ester IUPAC Name: [4-[[acetyl(butan-2-yl)amino]methyl]phenyl] 4-methoxybenzenesulfonate Traditional Name: 4-methoxybenzenesulfonic acid [4-[[acetyl(sec-butyl)amino]methyl]phenyl] ester Formula: C20H25NO5S MolecularWeight: 391.4812

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N(CC1=CC=C(C=C1)OS(=O)(=O)C2=CC=C(C=C2)OC)C(=O)C

Isomeric SMILES

CCC(C)N(CC1=CC=C(C=C1)OS(=O)(=O)C2=CC=C(C=C2)OC)C(=O)C

InChI

InChI=1S/C20H25NO5S/c1-5-15(2)21(16(3)22)14-17-6-8-19(9-7-17)26-27(23,24)20-12-10-18(25-4)11-13-20/h6-13,15H,5,14H2,1-4H3