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

Systemtic Name: methyl N-[4-ethyl-2-[3-(2-hydroxyphenyl)piperazin-1-yl]phenyl]sulfamate Openeye Name: methyl N-[4-ethyl-2-[3-(2-hydroxyphenyl)piperazin-1-yl]phenyl]sulfamate CAS Name: N-[4-ethyl-2-[3-(2-hydroxyphenyl)-1-piperazinyl]phenyl]sulfamic acid methyl ester IUPAC Name: methyl N-[4-ethyl-2-[3-(2-hydroxyphenyl)piperazin-1-yl]phenyl]sulfamate Traditional Name: N-[4-ethyl-2-[3-(2-hydroxyphenyl)piperazino]phenyl]sulfamic acid methyl ester Formula: C19H25N3O4S MolecularWeight: 391.4845

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1)NS(=O)(=O)OC)N2CCNC(C2)C3=CC=CC=C3O

Isomeric SMILES

CCC1=CC(=C(C=C1)NS(=O)(=O)OC)N2CCNC(C2)C3=CC=CC=C3O

InChI

InChI=1S/C19H25N3O4S/c1-3-14-8-9-16(21-27(24,25)26-2)18(12-14)22-11-10-20-17(13-22)15-6-4-5-7-19(15)23/h4-9,12,17,20-21,23H,3,10-11,13H2,1-2H3