N-[4-[2-[[2-oxidanyl-3-(4-oxidanylphenoxy)propyl]amino]ethyl]phenyl]quinoline-8-sulfonamide

Systemtic Name: N-[4-[2-[[2-oxidanyl-3-(4-oxidanylphenoxy)propyl]amino]ethyl]phenyl]quinoline-8-sulfonamide Openeye Name: N-[4-[2-[[2-hydroxy-3-(4-hydroxyphenoxy)propyl]amino]ethyl]phenyl]quinoline-8-sulfonamide CAS Name: N-[4-[2-[[2-hydroxy-3-(4-hydroxyphenoxy)propyl]amino]ethyl]phenyl]-8-quinolinesulfonamide IUPAC Name: N-[4-[2-[[2-hydroxy-3-(4-hydroxyphenoxy)propyl]amino]ethyl]phenyl]quinoline-8-sulfonamide Traditional Name: N-[4-[2-[[2-hydroxy-3-(4-hydroxyphenoxy)propyl]amino]ethyl]phenyl]quinoline-8-sulfonamide Formula: C26H27N3O5S MolecularWeight: 493.57468

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)S(=O)(=O)NC3=CC=C(C=C3)CCNCC(COC4=CC=C(C=C4)O)O)N=CC=C2

Isomeric SMILES

C1=CC2=C(C(=C1)S(=O)(=O)NC3=CC=C(C=C3)CCNCC(COC4=CC=C(C=C4)O)O)N=CC=C2

InChI

InChI=1S/C26H27N3O5S/c30-22-10-12-24(13-11-22)34-18-23(31)17-27-16-14-19-6-8-21(9-7-19)29-35(32,33)25-5-1-3-20-4-2-15-28-26(20)25/h1-13,15,23,27,29-31H,14,16-18H2