8-(1,3-dithian-2-ylidenemethyl)-5,6,7-trimethoxy-isoquinoline

Systemtic Name: 8-(1,3-dithian-2-ylidenemethyl)-5,6,7-trimethoxy-isoquinoline Openeye Name: 8-(1,3-dithian-2-ylidenemethyl)-5,6,7-trimethoxy-isoquinoline CAS Name: 8-(1,3-dithian-2-ylidenemethyl)-5,6,7-trimethoxyisoquinoline IUPAC Name: 8-(1,3-dithian-2-ylidenemethyl)-5,6,7-trimethoxyisoquinoline Traditional Name: 8-(1,3-dithian-2-ylidenemethyl)-5,6,7-trimethoxy-isoquinoline Formula: C17H19NO3S2 MolecularWeight: 349.46766

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C2=C1C=CN=C2)C=C3SCCCS3)OC)OC

Isomeric SMILES

COC1=C(C(=C(C2=C1C=CN=C2)C=C3SCCCS3)OC)OC

InChI

InChI=1S/C17H19NO3S2/c1-19-15-11-5-6-18-10-13(11)12(16(20-2)17(15)21-3)9-14-22-7-4-8-23-14/h5-6,9-10H,4,7-8H2,1-3H3