N-[2-[2-[(3,4-dichlorophenyl)methoxy]ethylamino]ethyl]isoquinoline-5-sulfonamide

Systemtic Name: N-[2-[2-[(3,4-dichlorophenyl)methoxy]ethylamino]ethyl]isoquinoline-5-sulfonamide Openeye Name: N-[2-[2-[(3,4-dichlorophenyl)methoxy]ethylamino]ethyl]isoquinoline-5-sulfonamide CAS Name: N-[2-[2-[(3,4-dichlorophenyl)methoxy]ethylamino]ethyl]-5-isoquinolinesulfonamide IUPAC Name: N-[2-[2-[(3,4-dichlorophenyl)methoxy]ethylamino]ethyl]isoquinoline-5-sulfonamide Traditional Name: N-[2-[2-(3,4-dichlorobenzyl)oxyethylamino]ethyl]isoquinoline-5-sulfonamide Formula: C20H21Cl2N3O3S MolecularWeight: 454.37004

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CN=C2)C(=C1)S(=O)(=O)NCCNCCOCC3=CC(=C(C=C3)Cl)Cl

Isomeric SMILES

C1=CC2=C(C=CN=C2)C(=C1)S(=O)(=O)NCCNCCOCC3=CC(=C(C=C3)Cl)Cl

InChI

InChI=1S/C20H21Cl2N3O3S/c21-18-5-4-15(12-19(18)22)14-28-11-10-23-8-9-25-29(26,27)20-3-1-2-16-13-24-7-6-17(16)20/h1-7,12-13,23,25H,8-11,14H2