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

Systemtic Name: ethyl N-[2-(3-ethoxypiperazin-1-yl)-4-(2-hydroxyphenyl)phenyl]sulfamate Openeye Name: ethyl 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 ethyl ester IUPAC Name: ethyl N-[2-(3-ethoxypiperazin-1-yl)-4-(2-hydroxyphenyl)phenyl]sulfamate Traditional Name: N-[2-(3-ethoxypiperazino)-4-(2-hydroxyphenyl)phenyl]sulfamic acid ethyl ester Formula: C20H27N3O5S MolecularWeight: 421.51048

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H27N3O5S/c1-3-27-20-14-23(12-11-21-20)18-13-15(16-7-5-6-8-19(16)24)9-10-17(18)22-29(25,26)28-4-2/h5-10,13,20-22,24H,3-4,11-12,14H2,1-2H3