N-(2-azanylethyl)-5-chloranyl-1-oxidanylidene-4H-isoquinoline-8-sulfonamide

Systemtic Name: N-(2-azanylethyl)-5-chloranyl-1-oxidanylidene-4H-isoquinoline-8-sulfonamide Openeye Name: N-(2-aminoethyl)-5-chloro-1-oxo-4H-isoquinoline-8-sulfonamide CAS Name: N-(2-aminoethyl)-5-chloro-1-oxo-4H-isoquinoline-8-sulfonamide IUPAC Name: N-(2-aminoethyl)-5-chloro-1-oxo-4H-isoquinoline-8-sulfonamide Traditional Name: N-(2-aminoethyl)-5-chloro-1-keto-4H-isoquinoline-8-sulfonamide Formula: C11H12ClN3O3S MolecularWeight: 301.74928

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Descriptors Computed from Structure

Canonical SMILES:

C1C=NC(=O)C2=C(C=CC(=C21)Cl)S(=O)(=O)NCCN

Isomeric SMILES

C1C=NC(=O)C2=C(C=CC(=C21)Cl)S(=O)(=O)NCCN

InChI

InChI=1S/C11H12ClN3O3S/c12-8-1-2-9(19(17,18)15-6-4-13)10-7(8)3-5-14-11(10)16/h1-2,5,15H,3-4,6,13H2