(2-piperidin-1-ylphenyl) 4-acetamidobenzenesulfonate

Systemtic Name: (2-piperidin-1-ylphenyl) 4-acetamidobenzenesulfonate Openeye Name: [2-(1-piperidyl)phenyl] 4-acetamidobenzenesulfonate CAS Name: 4-acetamidobenzenesulfonic acid [2-(1-piperidinyl)phenyl] ester IUPAC Name: (2-piperidin-1-ylphenyl) 4-acetamidobenzenesulfonate Traditional Name: 4-acetamidobenzenesulfonic acid (2-piperidinophenyl) ester Formula: C19H22N2O4S MolecularWeight: 374.45398

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)OC2=CC=CC=C2N3CCCCC3

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)OC2=CC=CC=C2N3CCCCC3

InChI

InChI=1S/C19H22N2O4S/c1-15(22)20-16-9-11-17(12-10-16)26(23,24)25-19-8-4-3-7-18(19)21-13-5-2-6-14-21/h3-4,7-12H,2,5-6,13-14H2,1H3,(H,20,22)