N-[2-(2-phenylmethoxyethylamino)ethyl]isoquinoline-5-sulfonamide

Systemtic Name: N-[2-(2-phenylmethoxyethylamino)ethyl]isoquinoline-5-sulfonamide Openeye Name: N-[2-(2-benzyloxyethylamino)ethyl]isoquinoline-5-sulfonamide CAS Name: N-[2-(2-phenylmethoxyethylamino)ethyl]-5-isoquinolinesulfonamide IUPAC Name: N-[2-(2-phenylmethoxyethylamino)ethyl]isoquinoline-5-sulfonamide Traditional Name: N-[2-(2-benzoxyethylamino)ethyl]isoquinoline-5-sulfonamide Formula: C20H23N3O3S MolecularWeight: 385.47992

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COCCNCCNS(=O)(=O)C2=CC=CC3=C2C=CN=C3

Isomeric SMILES

C1=CC=C(C=C1)COCCNCCNS(=O)(=O)C2=CC=CC3=C2C=CN=C3

InChI

InChI=1S/C20H23N3O3S/c24-27(25,20-8-4-7-18-15-22-10-9-19(18)20)23-12-11-21-13-14-26-16-17-5-2-1-3-6-17/h1-10,15,21,23H,11-14,16H2