[2-[3-(2-hydroxyphenyl)piperazin-1-yl]-4-propyl-phenyl]sulfamic acid

Systemtic Name: [2-[3-(2-hydroxyphenyl)piperazin-1-yl]-4-propyl-phenyl]sulfamic acid Openeye Name: [2-[3-(2-hydroxyphenyl)piperazin-1-yl]-4-propyl-phenyl]sulfamic acid CAS Name: [2-[3-(2-hydroxyphenyl)-1-piperazinyl]-4-propylphenyl]sulfamic acid IUPAC Name: [2-[3-(2-hydroxyphenyl)piperazin-1-yl]-4-propylphenyl]sulfamic acid Traditional Name: [2-[3-(2-hydroxyphenyl)piperazino]-4-propyl-phenyl]sulfamic acid Formula: C19H25N3O4S MolecularWeight: 391.4845

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=C(C=C1)NS(=O)(=O)O)N2CCNC(C2)C3=CC=CC=C3O

Isomeric SMILES

CCCC1=CC(=C(C=C1)NS(=O)(=O)O)N2CCNC(C2)C3=CC=CC=C3O

InChI

InChI=1S/C19H25N3O4S/c1-2-5-14-8-9-16(21-27(24,25)26)18(12-14)22-11-10-20-17(13-22)15-6-3-4-7-19(15)23/h3-4,6-9,12,17,20-21,23H,2,5,10-11,13H2,1H3,(H,24,25,26)