[2-(pyridin-4-ylcarbonylamino)phenyl] 4-methoxybenzenesulfonate

Systemtic Name: [2-(pyridin-4-ylcarbonylamino)phenyl] 4-methoxybenzenesulfonate Openeye Name: [2-(pyridine-4-carbonylamino)phenyl] 4-methoxybenzenesulfonate CAS Name: 4-methoxybenzenesulfonic acid [2-[[oxo(pyridin-4-yl)methyl]amino]phenyl] ester IUPAC Name: [2-(pyridine-4-carbonylamino)phenyl] 4-methoxybenzenesulfonate Traditional Name: 4-methoxybenzenesulfonic acid (2-isonicotinamidophenyl) ester Formula: C19H16N2O5S MolecularWeight: 384.40574

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)OC2=CC=CC=C2NC(=O)C3=CC=NC=C3

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)OC2=CC=CC=C2NC(=O)C3=CC=NC=C3

InChI

InChI=1S/C19H16N2O5S/c1-25-15-6-8-16(9-7-15)27(23,24)26-18-5-3-2-4-17(18)21-19(22)14-10-12-20-13-11-14/h2-13H,1H3,(H,21,22)