(1-piperazin-1-ylisoquinolin-7-yl) sulfamate

Systemtic Name: (1-piperazin-1-ylisoquinolin-7-yl) sulfamate Openeye Name: (1-piperazin-1-yl-7-isoquinolyl) sulfamate CAS Name: sulfamic acid [1-(1-piperazinyl)-7-isoquinolinyl] ester IUPAC Name: (1-piperazin-1-ylisoquinolin-7-yl) sulfamate Traditional Name: sulfamic acid (1-piperazino-7-isoquinolyl) ester Formula: C13H16N4O3S MolecularWeight: 308.35614

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2=NC=CC3=C2C=C(C=C3)OS(=O)(=O)N

Isomeric SMILES

C1CN(CCN1)C2=NC=CC3=C2C=C(C=C3)OS(=O)(=O)N

InChI

InChI=1S/C13H16N4O3S/c14-21(18,19)20-11-2-1-10-3-4-16-13(12(10)9-11)17-7-5-15-6-8-17/h1-4,9,15H,5-8H2,(H2,14,18,19)