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

Systemtic Name: ethyl N-[2-(3-ethoxypiperazin-1-yl)-4-(2-methylpropyl)phenyl]sulfamate Openeye Name: ethyl N-[2-(3-ethoxypiperazin-1-yl)-4-isobutyl-phenyl]sulfamate CAS Name: N-[2-(3-ethoxy-1-piperazinyl)-4-(2-methylpropyl)phenyl]sulfamic acid ethyl ester IUPAC Name: ethyl N-[2-(3-ethoxypiperazin-1-yl)-4-(2-methylpropyl)phenyl]sulfamate Traditional Name: N-[2-(3-ethoxypiperazino)-4-isobutyl-phenyl]sulfamic acid ethyl ester Formula: C18H31N3O4S MolecularWeight: 385.52144

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H31N3O4S/c1-5-24-18-13-21(10-9-19-18)17-12-15(11-14(3)4)7-8-16(17)20-26(22,23)25-6-2/h7-8,12,14,18-20H,5-6,9-11,13H2,1-4H3