[2-(4-chloranylphenoxy)phenyl]sulfonyl-methyl-(oxan-4-yl)-phenylmethoxy-azanium

Systemtic Name: [2-(4-chloranylphenoxy)phenyl]sulfonyl-methyl-(oxan-4-yl)-phenylmethoxy-azanium Openeye Name: benzyloxy-[2-(4-chlorophenoxy)phenyl]sulfonyl-methyl-tetrahydropyran-4-yl-ammonium CAS Name: [2-(4-chlorophenoxy)phenyl]sulfonyl-methyl-(4-oxanyl)-phenylmethoxyammonium IUPAC Name: [2-(4-chlorophenoxy)phenyl]sulfonyl-methyl-(oxan-4-yl)-phenylmethoxyazanium Traditional Name: benzoxy-[2-(4-chlorophenoxy)phenyl]sulfonyl-methyl-tetrahydropyran-4-yl-ammonium Formula: C25H27ClNO5S+ MolecularWeight: 489.00358

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C1CCOCC1)(OCC2=CC=CC=C2)S(=O)(=O)C3=CC=CC=C3OC4=CC=C(C=C4)Cl

Isomeric SMILES

C[N+](C1CCOCC1)(OCC2=CC=CC=C2)S(=O)(=O)C3=CC=CC=C3OC4=CC=C(C=C4)Cl

InChI

InChI=1S/C25H27ClNO5S/c1-27(22-15-17-30-18-16-22,31-19-20-7-3-2-4-8-20)33(28,29)25-10-6-5-9-24(25)32-23-13-11-21(26)12-14-23/h2-14,22H,15-19H2,1H3/q+1