isoquinolin-1-yl N-(phenylsulfonylamino)carbamate

Systemtic Name: isoquinolin-1-yl N-(phenylsulfonylamino)carbamate Openeye Name: 1-isoquinolyl N-(benzenesulfonamido)carbamate CAS Name: N-(benzenesulfonamido)carbamic acid 1-isoquinolinyl ester IUPAC Name: isoquinolin-1-yl N-(benzenesulfonamido)carbamate Traditional Name: N-(benzenesulfonamido)carbamic acid 1-isoquinolyl ester Formula: C16H13N3O4S MolecularWeight: 343.35712

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)NNC(=O)OC2=NC=CC3=CC=CC=C32

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)NNC(=O)OC2=NC=CC3=CC=CC=C32

InChI

InChI=1S/C16H13N3O4S/c20-16(18-19-24(21,22)13-7-2-1-3-8-13)23-15-14-9-5-4-6-12(14)10-11-17-15/h1-11,19H,(H,18,20)