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

Systemtic Name: methyl N-[2-(3-ethoxypiperazin-1-yl)-4-(2-hydroxyphenyl)phenyl]sulfamate Openeye Name: methyl N-[2-(3-ethoxypiperazin-1-yl)-4-(2-hydroxyphenyl)phenyl]sulfamate CAS Name: N-[2-(3-ethoxy-1-piperazinyl)-4-(2-hydroxyphenyl)phenyl]sulfamic acid methyl ester IUPAC Name: methyl N-[2-(3-ethoxypiperazin-1-yl)-4-(2-hydroxyphenyl)phenyl]sulfamate Traditional Name: N-[2-(3-ethoxypiperazino)-4-(2-hydroxyphenyl)phenyl]sulfamic acid methyl ester Formula: C19H25N3O5S MolecularWeight: 407.4839

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1CN(CCN1)C2=C(C=CC(=C2)C3=CC=CC=C3O)NS(=O)(=O)OC

Isomeric SMILES

CCOC1CN(CCN1)C2=C(C=CC(=C2)C3=CC=CC=C3O)NS(=O)(=O)OC

InChI

InChI=1S/C19H25N3O5S/c1-3-27-19-13-22(11-10-20-19)17-12-14(15-6-4-5-7-18(15)23)8-9-16(17)21-28(24,25)26-2/h4-9,12,19-21,23H,3,10-11,13H2,1-2H3