2-[2-(4-phenyl-2H-pyridin-1-yl)ethylcarbamoyl]benzenesulfonic acid

Systemtic Name: 2-[2-(4-phenyl-2H-pyridin-1-yl)ethylcarbamoyl]benzenesulfonic acid Openeye Name: 2-[2-(4-phenyl-2H-pyridin-1-yl)ethylcarbamoyl]benzenesulfonic acid CAS Name: 2-[oxo-[2-(4-phenyl-2H-pyridin-1-yl)ethylamino]methyl]benzenesulfonic acid IUPAC Name: 2-[2-(4-phenyl-2H-pyridin-1-yl)ethylcarbamoyl]benzenesulfonic acid Traditional Name: 2-[2-(4-phenyl-2H-pyridin-1-yl)ethylcarbamoyl]besylic acid Formula: C20H20N2O4S MolecularWeight: 384.4488

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Descriptors Computed from Structure

Canonical SMILES:

C1C=C(C=CN1CCNC(=O)C2=CC=CC=C2S(=O)(=O)O)C3=CC=CC=C3

Isomeric SMILES

C1C=C(C=CN1CCNC(=O)C2=CC=CC=C2S(=O)(=O)O)C3=CC=CC=C3

InChI

InChI=1S/C20H20N2O4S/c23-20(18-8-4-5-9-19(18)27(24,25)26)21-12-15-22-13-10-17(11-14-22)16-6-2-1-3-7-16/h1-11,13H,12,14-15H2,(H,21,23)(H,24,25,26)