[2-(3-propan-2-ylsulfonylpiperazin-1-yl)-4-propyl-phenyl]sulfamic acid

Systemtic Name: [2-(3-propan-2-ylsulfonylpiperazin-1-yl)-4-propyl-phenyl]sulfamic acid Openeye Name: [2-(3-isopropylsulfonylpiperazin-1-yl)-4-propyl-phenyl]sulfamic acid CAS Name: [2-(3-propan-2-ylsulfonyl-1-piperazinyl)-4-propylphenyl]sulfamic acid IUPAC Name: [2-(3-propan-2-ylsulfonylpiperazin-1-yl)-4-propylphenyl]sulfamic acid Traditional Name: [2-(3-isopropylsulfonylpiperazino)-4-propyl-phenyl]sulfamic acid Formula: C16H27N3O5S2 MolecularWeight: 405.53268

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=C(C=C1)NS(=O)(=O)O)N2CCNC(C2)S(=O)(=O)C(C)C

Isomeric SMILES

CCCC1=CC(=C(C=C1)NS(=O)(=O)O)N2CCNC(C2)S(=O)(=O)C(C)C

InChI

InChI=1S/C16H27N3O5S2/c1-4-5-13-6-7-14(18-26(22,23)24)15(10-13)19-9-8-17-16(11-19)25(20,21)12(2)3/h6-7,10,12,16-18H,4-5,8-9,11H2,1-3H3,(H,22,23,24)