methyl N-[4-(2-hydroxyphenyl)-2-(3-oxidanylpiperazin-1-yl)phenyl]sulfamate

Systemtic Name: methyl N-[4-(2-hydroxyphenyl)-2-(3-oxidanylpiperazin-1-yl)phenyl]sulfamate Openeye Name: methyl N-[4-(2-hydroxyphenyl)-2-(3-hydroxypiperazin-1-yl)phenyl]sulfamate CAS Name: N-[4-(2-hydroxyphenyl)-2-(3-hydroxy-1-piperazinyl)phenyl]sulfamic acid methyl ester IUPAC Name: methyl N-[4-(2-hydroxyphenyl)-2-(3-hydroxypiperazin-1-yl)phenyl]sulfamate Traditional Name: N-[4-(2-hydroxyphenyl)-2-(3-hydroxypiperazino)phenyl]sulfamic acid methyl ester Formula: C17H21N3O5S MolecularWeight: 379.43074

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Descriptors Computed from Structure

Canonical SMILES:

COS(=O)(=O)NC1=C(C=C(C=C1)C2=CC=CC=C2O)N3CCNC(C3)O

Isomeric SMILES

COS(=O)(=O)NC1=C(C=C(C=C1)C2=CC=CC=C2O)N3CCNC(C3)O

InChI

InChI=1S/C17H21N3O5S/c1-25-26(23,24)19-14-7-6-12(13-4-2-3-5-16(13)21)10-15(14)20-9-8-18-17(22)11-20/h2-7,10,17-19,21-22H,8-9,11H2,1H3