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

Systemtic Name: methyl N-[2-(3-oxidanylpiperazin-1-yl)-4-phenyl-phenyl]sulfamate Openeye Name: methyl N-[2-(3-hydroxypiperazin-1-yl)-4-phenyl-phenyl]sulfamate CAS Name: N-[2-(3-hydroxy-1-piperazinyl)-4-phenylphenyl]sulfamic acid methyl ester IUPAC Name: methyl N-[2-(3-hydroxypiperazin-1-yl)-4-phenylphenyl]sulfamate Traditional Name: N-[2-(3-hydroxypiperazino)-4-phenyl-phenyl]sulfamic acid methyl ester Formula: C17H21N3O4S MolecularWeight: 363.43134

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H21N3O4S/c1-24-25(22,23)19-15-8-7-14(13-5-3-2-4-6-13)11-16(15)20-10-9-18-17(21)12-20/h2-8,11,17-19,21H,9-10,12H2,1H3