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

Systemtic Name: [4-(2-methylpropyl)-2-(3-propan-2-ylsulfonylpiperazin-1-yl)phenyl]sulfamic acid Openeye Name: [4-isobutyl-2-(3-isopropylsulfonylpiperazin-1-yl)phenyl]sulfamic acid CAS Name: [4-(2-methylpropyl)-2-(3-propan-2-ylsulfonyl-1-piperazinyl)phenyl]sulfamic acid IUPAC Name: [4-(2-methylpropyl)-2-(3-propan-2-ylsulfonylpiperazin-1-yl)phenyl]sulfamic acid Traditional Name: [4-isobutyl-2-(3-isopropylsulfonylpiperazino)phenyl]sulfamic acid Formula: C17H29N3O5S2 MolecularWeight: 419.55926

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=CC(=C(C=C1)NS(=O)(=O)O)N2CCNC(C2)S(=O)(=O)C(C)C

Isomeric SMILES

CC(C)CC1=CC(=C(C=C1)NS(=O)(=O)O)N2CCNC(C2)S(=O)(=O)C(C)C

InChI

InChI=1S/C17H29N3O5S2/c1-12(2)9-14-5-6-15(19-27(23,24)25)16(10-14)20-8-7-18-17(11-20)26(21,22)13(3)4/h5-6,10,12-13,17-19H,7-9,11H2,1-4H3,(H,23,24,25)