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

Systemtic Name: methyl N-[4-ethyl-2-(3-oxidanylpiperazin-1-yl)phenyl]sulfamate Openeye Name: methyl N-[4-ethyl-2-(3-hydroxypiperazin-1-yl)phenyl]sulfamate CAS Name: N-[4-ethyl-2-(3-hydroxy-1-piperazinyl)phenyl]sulfamic acid methyl ester IUPAC Name: methyl N-[4-ethyl-2-(3-hydroxypiperazin-1-yl)phenyl]sulfamate Traditional Name: N-[4-ethyl-2-(3-hydroxypiperazino)phenyl]sulfamic acid methyl ester Formula: C13H21N3O4S MolecularWeight: 315.38854

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1)NS(=O)(=O)OC)N2CCNC(C2)O

Isomeric SMILES

CCC1=CC(=C(C=C1)NS(=O)(=O)OC)N2CCNC(C2)O

InChI

InChI=1S/C13H21N3O4S/c1-3-10-4-5-11(15-21(18,19)20-2)12(8-10)16-7-6-14-13(17)9-16/h4-5,8,13-15,17H,3,6-7,9H2,1-2H3