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

Systemtic Name: ethanedioic acid; N-[1-methoxy-2-[(2-oxidanyl-3-phenoxy-propyl)amino]ethyl]benzenesulfonamide Openeye Name: N-[2-[(2-hydroxy-3-phenoxy-propyl)amino]-1-methoxy-ethyl]benzenesulfonamide; oxalic acid CAS Name: N-[2-[(2-hydroxy-3-phenoxypropyl)amino]-1-methoxyethyl]benzenesulfonamide; oxalic acid IUPAC Name: N-[2-[(2-hydroxy-3-phenoxypropyl)amino]-1-methoxyethyl]benzenesulfonamide; oxalic acid Traditional Name: N-[2-[(2-hydroxy-3-phenoxy-propyl)amino]-1-methoxy-ethyl]benzenesulfonamide; oxalic acid Formula: C20H26N2O9S MolecularWeight: 470.49344

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Descriptors Computed from Structure

Canonical SMILES:

COC(CNCC(COC1=CC=CC=C1)O)NS(=O)(=O)C2=CC=CC=C2.C(=O)(C(=O)O)O

Isomeric SMILES

COC(CNCC(COC1=CC=CC=C1)O)NS(=O)(=O)C2=CC=CC=C2.C(=O)(C(=O)O)O

InChI

InChI=1S/C18H24N2O5S.C2H2O4/c1-24-18(20-26(22,23)17-10-6-3-7-11-17)13-19-12-15(21)14-25-16-8-4-2-5-9-16;3-1(4)2(5)6/h2-11,15,18-21H,12-14H2,1H3;(H,3,4)(H,5,6)