ethanedioic acid; N-[1-[(2-oxidanyl-3-phenoxy-propyl)amino]ethyl]benzenesulfonamide

Systemtic Name: ethanedioic acid; N-[1-[(2-oxidanyl-3-phenoxy-propyl)amino]ethyl]benzenesulfonamide Openeye Name: N-[1-[(2-hydroxy-3-phenoxy-propyl)amino]ethyl]benzenesulfonamide; oxalic acid CAS Name: N-[1-[(2-hydroxy-3-phenoxypropyl)amino]ethyl]benzenesulfonamide; oxalic acid IUPAC Name: N-[1-[(2-hydroxy-3-phenoxypropyl)amino]ethyl]benzenesulfonamide; oxalic acid Traditional Name: N-[1-[(2-hydroxy-3-phenoxy-propyl)amino]ethyl]benzenesulfonamide; oxalic acid Formula: C19H24N2O8S MolecularWeight: 440.46746

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Descriptors Computed from Structure

Canonical SMILES:

CC(NCC(COC1=CC=CC=C1)O)NS(=O)(=O)C2=CC=CC=C2.C(=O)(C(=O)O)O

Isomeric SMILES

CC(NCC(COC1=CC=CC=C1)O)NS(=O)(=O)C2=CC=CC=C2.C(=O)(C(=O)O)O

InChI

InChI=1S/C17H22N2O4S.C2H2O4/c1-14(19-24(21,22)17-10-6-3-7-11-17)18-12-15(20)13-23-16-8-4-2-5-9-16;3-1(4)2(5)6/h2-11,14-15,18-20H,12-13H2,1H3;(H,3,4)(H,5,6)