[4-(2-hydroxyphenyl)-2-[3-(2-hydroxyphenyl)piperazin-1-yl]phenyl]sulfamic acid

Systemtic Name: [4-(2-hydroxyphenyl)-2-[3-(2-hydroxyphenyl)piperazin-1-yl]phenyl]sulfamic acid Openeye Name: [4-(2-hydroxyphenyl)-2-[3-(2-hydroxyphenyl)piperazin-1-yl]phenyl]sulfamic acid CAS Name: [4-(2-hydroxyphenyl)-2-[3-(2-hydroxyphenyl)-1-piperazinyl]phenyl]sulfamic acid IUPAC Name: [4-(2-hydroxyphenyl)-2-[3-(2-hydroxyphenyl)piperazin-1-yl]phenyl]sulfamic acid Traditional Name: [4-(2-hydroxyphenyl)-2-[3-(2-hydroxyphenyl)piperazino]phenyl]sulfamic acid Formula: C22H23N3O5S MolecularWeight: 441.50012

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(N1)C2=CC=CC=C2O)C3=C(C=CC(=C3)C4=CC=CC=C4O)NS(=O)(=O)O

Isomeric SMILES

C1CN(CC(N1)C2=CC=CC=C2O)C3=C(C=CC(=C3)C4=CC=CC=C4O)NS(=O)(=O)O

InChI

InChI=1S/C22H23N3O5S/c26-21-7-3-1-5-16(21)15-9-10-18(24-31(28,29)30)20(13-15)25-12-11-23-19(14-25)17-6-2-4-8-22(17)27/h1-10,13,19,23-24,26-27H,11-12,14H2,(H,28,29,30)