2-(4-iodanyl-3-methoxy-phenyl)sulfonyl-3,4-dihydro-1H-isoquinoline

Systemtic Name: 2-(4-iodanyl-3-methoxy-phenyl)sulfonyl-3,4-dihydro-1H-isoquinoline Openeye Name: 2-(4-iodo-3-methoxy-phenyl)sulfonyl-3,4-dihydro-1H-isoquinoline CAS Name: 2-(4-iodo-3-methoxyphenyl)sulfonyl-3,4-dihydro-1H-isoquinoline IUPAC Name: 2-(4-iodo-3-methoxyphenyl)sulfonyl-3,4-dihydro-1H-isoquinoline Traditional Name: 2-(4-iodo-3-methoxy-phenyl)sulfonyl-3,4-dihydro-1H-isoquinoline Formula: C16H16INO3S MolecularWeight: 429.27261

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)S(=O)(=O)N2CCC3=CC=CC=C3C2)I

Isomeric SMILES

COC1=C(C=CC(=C1)S(=O)(=O)N2CCC3=CC=CC=C3C2)I

InChI

InChI=1S/C16H16INO3S/c1-21-16-10-14(6-7-15(16)17)22(19,20)18-9-8-12-4-2-3-5-13(12)11-18/h2-7,10H,8-9,11H2,1H3