[2-(2-pyridin-4-ylethyl)phenyl]iminosulfamic acid

Systemtic Name: [2-(2-pyridin-4-ylethyl)phenyl]iminosulfamic acid Openeye Name: [2-[2-(4-pyridyl)ethyl]phenyl]iminosulfamic acid CAS Name: [2-(2-pyridin-4-ylethyl)phenyl]iminosulfamic acid IUPAC Name: [2-(2-pyridin-4-ylethyl)phenyl]iminosulfamic acid Traditional Name: [2-[2-(4-pyridyl)ethyl]phenyl]iminosulfamic acid Formula: C13H13N3O3S MolecularWeight: 291.32562

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CCC2=CC=NC=C2)N=NS(=O)(=O)O

Isomeric SMILES

C1=CC=C(C(=C1)CCC2=CC=NC=C2)N=NS(=O)(=O)O

InChI

InChI=1S/C13H13N3O3S/c17-20(18,19)16-15-13-4-2-1-3-12(13)6-5-11-7-9-14-10-8-11/h1-4,7-10H,5-6H2,(H,17,18,19)