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

Systemtic Name: [4-(2-hydroxyphenyl)-2-[3-(phenylmethyl)piperazin-1-yl]phenyl]sulfamic acid Openeye Name: [2-(3-benzylpiperazin-1-yl)-4-(2-hydroxyphenyl)phenyl]sulfamic acid CAS Name: [4-(2-hydroxyphenyl)-2-[3-(phenylmethyl)-1-piperazinyl]phenyl]sulfamic acid IUPAC Name: [2-(3-benzylpiperazin-1-yl)-4-(2-hydroxyphenyl)phenyl]sulfamic acid Traditional Name: [2-(3-benzylpiperazino)-4-(2-hydroxyphenyl)phenyl]sulfamic acid Formula: C23H25N3O4S MolecularWeight: 439.5273

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(N1)CC2=CC=CC=C2)C3=C(C=CC(=C3)C4=CC=CC=C4O)NS(=O)(=O)O

Isomeric SMILES

C1CN(CC(N1)CC2=CC=CC=C2)C3=C(C=CC(=C3)C4=CC=CC=C4O)NS(=O)(=O)O

InChI

InChI=1S/C23H25N3O4S/c27-23-9-5-4-8-20(23)18-10-11-21(25-31(28,29)30)22(15-18)26-13-12-24-19(16-26)14-17-6-2-1-3-7-17/h1-11,15,19,24-25,27H,12-14,16H2,(H,28,29,30)