[2-(3-phenoxysulfonylpiperazin-1-yl)-4-propan-2-ylsulfonyl-phenyl]sulfamic acid

Systemtic Name: [2-(3-phenoxysulfonylpiperazin-1-yl)-4-propan-2-ylsulfonyl-phenyl]sulfamic acid Openeye Name: [4-isopropylsulfonyl-2-(3-phenoxysulfonylpiperazin-1-yl)phenyl]sulfamic acid CAS Name: [2-(3-phenoxysulfonyl-1-piperazinyl)-4-propan-2-ylsulfonylphenyl]sulfamic acid IUPAC Name: [2-(3-phenoxysulfonylpiperazin-1-yl)-4-propan-2-ylsulfonylphenyl]sulfamic acid Traditional Name: [4-isopropylsulfonyl-2-(3-phenoxysulfonylpiperazino)phenyl]sulfamic acid Formula: C19H25N3O8S3 MolecularWeight: 519.6121

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)C1=CC(=C(C=C1)NS(=O)(=O)O)N2CCNC(C2)S(=O)(=O)OC3=CC=CC=C3

Isomeric SMILES

CC(C)S(=O)(=O)C1=CC(=C(C=C1)NS(=O)(=O)O)N2CCNC(C2)S(=O)(=O)OC3=CC=CC=C3

InChI

InChI=1S/C19H25N3O8S3/c1-14(2)31(23,24)16-8-9-17(21-33(27,28)29)18(12-16)22-11-10-20-19(13-22)32(25,26)30-15-6-4-3-5-7-15/h3-9,12,14,19-21H,10-11,13H2,1-2H3,(H,27,28,29)