3-methyl-2-oxidanidyl-isoquinolin-2-ium-1-carbonitrile

Systemtic Name: 3-methyl-2-oxidanidyl-isoquinolin-2-ium-1-carbonitrile Openeye Name: 3-methyl-2-oxido-isoquinolin-2-ium-1-carbonitrile CAS Name: 3-methyl-2-oxido-1-isoquinolin-2-iumcarbonitrile IUPAC Name: 3-methyl-2-oxidoisoquinolin-2-ium-1-carbonitrile Traditional Name: 3-methyl-2-oxido-isoquinolin-2-ium-1-carbonitrile Formula: C11H8N2O MolecularWeight: 184.19402

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=CC=CC=C2C(=[N+]1[O-])C#N

Isomeric SMILES

CC1=CC2=CC=CC=C2C(=[N+]1[O-])C#N

InChI

InChI=1S/C11H8N2O/c1-8-6-9-4-2-3-5-10(9)11(7-12)13(8)14/h2-6H,1H3