N-[2-(3-bromanyl-4-methoxy-phenyl)ethyl]isoquinoline-5-sulfonamide

Systemtic Name: N-[2-(3-bromanyl-4-methoxy-phenyl)ethyl]isoquinoline-5-sulfonamide Openeye Name: N-[2-(3-bromo-4-methoxy-phenyl)ethyl]isoquinoline-5-sulfonamide CAS Name: N-[2-(3-bromo-4-methoxyphenyl)ethyl]-5-isoquinolinesulfonamide IUPAC Name: N-[2-(3-bromo-4-methoxyphenyl)ethyl]isoquinoline-5-sulfonamide Traditional Name: N-[2-(3-bromo-4-methoxy-phenyl)ethyl]isoquinoline-5-sulfonamide Formula: C18H17BrN2O3S MolecularWeight: 421.30818

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNS(=O)(=O)C2=CC=CC3=C2C=CN=C3)Br

Isomeric SMILES

COC1=C(C=C(C=C1)CCNS(=O)(=O)C2=CC=CC3=C2C=CN=C3)Br

InChI

InChI=1S/C18H17BrN2O3S/c1-24-17-6-5-13(11-16(17)19)7-10-21-25(22,23)18-4-2-3-14-12-20-9-8-15(14)18/h2-6,8-9,11-12,21H,7,10H2,1H3