N-(2-azanylethyl)-N-hexyl-isoquinoline-5-sulfonamide hydrochloride

Systemtic Name: N-(2-azanylethyl)-N-hexyl-isoquinoline-5-sulfonamide hydrochloride Openeye Name: N-(2-aminoethyl)-N-hexyl-isoquinoline-5-sulfonamide hydrochloride CAS Name: N-(2-aminoethyl)-N-hexyl-5-isoquinolinesulfonamide hydrochloride IUPAC Name: N-(2-aminoethyl)-N-hexylisoquinoline-5-sulfonamide hydrochloride Traditional Name: N-(2-aminoethyl)-N-hexyl-isoquinoline-5-sulfonamide hydrochloride Formula: C17H26ClN3O2S MolecularWeight: 371.92524

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN(CCN)S(=O)(=O)C1=CC=CC2=C1C=CN=C2.Cl

Isomeric SMILES

CCCCCCN(CCN)S(=O)(=O)C1=CC=CC2=C1C=CN=C2.Cl

InChI

InChI=1S/C17H25N3O2S.ClH/c1-2-3-4-5-12-20(13-10-18)23(21,22)17-8-6-7-15-14-19-11-9-16(15)17;/h6-9,11,14H,2-5,10,12-13,18H2,1H3;1H