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

Systemtic Name: [4-(2-hydroxyphenyl)-2-(3-iodanylpiperazin-1-yl)phenyl]sulfamic acid Openeye Name: [4-(2-hydroxyphenyl)-2-(3-iodopiperazin-1-yl)phenyl]sulfamic acid CAS Name: [4-(2-hydroxyphenyl)-2-(3-iodo-1-piperazinyl)phenyl]sulfamic acid IUPAC Name: [4-(2-hydroxyphenyl)-2-(3-iodopiperazin-1-yl)phenyl]sulfamic acid Traditional Name: [4-(2-hydroxyphenyl)-2-(3-iodopiperazino)phenyl]sulfamic acid Formula: C16H18IN3O4S MolecularWeight: 475.30129

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(N1)I)C2=C(C=CC(=C2)C3=CC=CC=C3O)NS(=O)(=O)O

Isomeric SMILES

C1CN(CC(N1)I)C2=C(C=CC(=C2)C3=CC=CC=C3O)NS(=O)(=O)O

InChI

InChI=1S/C16H18IN3O4S/c17-16-10-20(8-7-18-16)14-9-11(12-3-1-2-4-15(12)21)5-6-13(14)19-25(22,23)24/h1-6,9,16,18-19,21H,7-8,10H2,(H,22,23,24)