5,11-dimethyl-2-oxidanidyl-[1]benzothiolo[2,3-g]isoquinolin-2-ium 6,6-dioxide

Systemtic Name: 5,11-dimethyl-2-oxidanidyl-[1]benzothiolo[2,3-g]isoquinolin-2-ium 6,6-dioxide Openeye Name: 5,11-dimethyl-2-oxido-benzothiopheno[2,3-g]isoquinolin-2-ium 6,6-dioxide CAS Name: 5,11-dimethyl-2-oxido-[1]benzothiolo[2,3-g]isoquinolin-2-ium 6,6-dioxide IUPAC Name: 5,11-dimethyl-2-oxido-[1]benzothiolo[2,3-g]isoquinolin-2-ium 6,6-dioxide Traditional Name: 5,11-dimethyl-2-oxido-benzothiophen[2,3-g]isoquinolin-2-ium 6,6-dioxide Formula: C17H13NO3S MolecularWeight: 311.35502

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C3=C1C=C[N+](=C3)[O-])C)C4=CC=CC=C4S2(=O)=O

Isomeric SMILES

CC1=C2C(=C(C3=C1C=C[N+](=C3)[O-])C)C4=CC=CC=C4S2(=O)=O

InChI

InChI=1S/C17H13NO3S/c1-10-14-9-18(19)8-7-12(14)11(2)17-16(10)13-5-3-4-6-15(13)22(17,20)21/h3-9H,1-2H3