6,7-dimethoxy-2-oxidanidyl-3-thiophen-3-yl-isoquinolin-2-ium

Systemtic Name: 6,7-dimethoxy-2-oxidanidyl-3-thiophen-3-yl-isoquinolin-2-ium Openeye Name: 6,7-dimethoxy-2-oxido-3-(3-thienyl)isoquinolin-2-ium CAS Name: 6,7-dimethoxy-2-oxido-3-(3-thiophenyl)isoquinolin-2-ium IUPAC Name: 6,7-dimethoxy-2-oxido-3-thiophen-3-ylisoquinolin-2-ium Traditional Name: 6,7-dimethoxy-2-oxido-3-(3-thienyl)isoquinolin-2-ium Formula: C15H13NO3S MolecularWeight: 287.33362

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C=[N+](C(=CC2=C1)C3=CSC=C3)[O-])OC

Isomeric SMILES

COC1=C(C=C2C=[N+](C(=CC2=C1)C3=CSC=C3)[O-])OC

InChI

InChI=1S/C15H13NO3S/c1-18-14-6-11-5-13(10-3-4-20-9-10)16(17)8-12(11)7-15(14)19-2/h3-9H,1-2H3