[3-[(8-acetamidoquinolin-5-yl)sulfonylmethyl]phenyl] ethanoate

Systemtic Name: [3-[(8-acetamidoquinolin-5-yl)sulfonylmethyl]phenyl] ethanoate Openeye Name: [3-[(8-acetamido-5-quinolyl)sulfonylmethyl]phenyl] acetate CAS Name: acetic acid [3-[(8-acetamido-5-quinolinyl)sulfonylmethyl]phenyl] ester IUPAC Name: [3-[(8-acetamidoquinolin-5-yl)sulfonylmethyl]phenyl] acetate Traditional Name: acetic acid [3-[(8-acetamido-5-quinolyl)sulfonylmethyl]phenyl] ester Formula: C20H18N2O5S MolecularWeight: 398.43232

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C2C(=C(C=C1)S(=O)(=O)CC3=CC(=CC=C3)OC(=O)C)C=CC=N2

Isomeric SMILES

CC(=O)NC1=C2C(=C(C=C1)S(=O)(=O)CC3=CC(=CC=C3)OC(=O)C)C=CC=N2

InChI

InChI=1S/C20H18N2O5S/c1-13(23)22-18-8-9-19(17-7-4-10-21-20(17)18)28(25,26)12-15-5-3-6-16(11-15)27-14(2)24/h3-11H,12H2,1-2H3,(H,22,23)