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

Systemtic Name: [2-[3-(2-hydroxyphenyl)piperazin-1-yl]-4-phenoxysulfonyl-phenyl]sulfamic acid Openeye Name: [2-[3-(2-hydroxyphenyl)piperazin-1-yl]-4-phenoxysulfonyl-phenyl]sulfamic acid CAS Name: [2-[3-(2-hydroxyphenyl)-1-piperazinyl]-4-phenoxysulfonylphenyl]sulfamic acid IUPAC Name: [2-[3-(2-hydroxyphenyl)piperazin-1-yl]-4-phenoxysulfonylphenyl]sulfamic acid Traditional Name: [2-[3-(2-hydroxyphenyl)piperazino]-4-phenoxysulfonyl-phenyl]sulfamic acid Formula: C22H23N3O7S2 MolecularWeight: 505.56392

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(N1)C2=CC=CC=C2O)C3=C(C=CC(=C3)S(=O)(=O)OC4=CC=CC=C4)NS(=O)(=O)O

Isomeric SMILES

C1CN(CC(N1)C2=CC=CC=C2O)C3=C(C=CC(=C3)S(=O)(=O)OC4=CC=CC=C4)NS(=O)(=O)O

InChI

InChI=1S/C22H23N3O7S2/c26-22-9-5-4-8-18(22)20-15-25(13-12-23-20)21-14-17(10-11-19(21)24-34(29,30)31)33(27,28)32-16-6-2-1-3-7-16/h1-11,14,20,23-24,26H,12-13,15H2,(H,29,30,31)