3-methoxy-1-[2-(propan-2-ylsulfonylsulfonylamino)-5-propyl-phenyl]piperazine

Systemtic Name: 3-methoxy-1-[2-(propan-2-ylsulfonylsulfonylamino)-5-propyl-phenyl]piperazine Openeye Name: 1-[2-(isopropylsulfonylsulfonylamino)-5-propyl-phenyl]-3-methoxy-piperazine CAS Name: 3-methoxy-1-[2-(propan-2-ylsulfonylsulfonylamino)-5-propylphenyl]piperazine IUPAC Name: 3-methoxy-1-[2-(propan-2-ylsulfonylsulfonylamino)-5-propylphenyl]piperazine Traditional Name: 1-[2-(isopropylsulfonylsulfonylamino)-5-propyl-phenyl]-3-methoxy-piperazine Formula: C17H29N3O5S2 MolecularWeight: 419.55926

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H29N3O5S2/c1-5-6-14-7-8-15(19-27(23,24)26(21,22)13(2)3)16(11-14)20-10-9-18-17(12-20)25-4/h7-8,11,13,17-19H,5-6,9-10,12H2,1-4H3