[2-(3-ethoxypiperazin-1-yl)-4-(2-methylpropyl)phenyl]sulfamic acid

Systemtic Name: [2-(3-ethoxypiperazin-1-yl)-4-(2-methylpropyl)phenyl]sulfamic acid Openeye Name: [2-(3-ethoxypiperazin-1-yl)-4-isobutyl-phenyl]sulfamic acid CAS Name: [2-(3-ethoxy-1-piperazinyl)-4-(2-methylpropyl)phenyl]sulfamic acid IUPAC Name: [2-(3-ethoxypiperazin-1-yl)-4-(2-methylpropyl)phenyl]sulfamic acid Traditional Name: [2-(3-ethoxypiperazino)-4-isobutyl-phenyl]sulfamic acid Formula: C16H27N3O4S MolecularWeight: 357.46828

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H27N3O4S/c1-4-23-16-11-19(8-7-17-16)15-10-13(9-12(2)3)5-6-14(15)18-24(20,21)22/h5-6,10,12,16-18H,4,7-9,11H2,1-3H3,(H,20,21,22)