3-methyl-5-nitro-2-oxidanidyl-isoquinolin-2-ium

Systemtic Name: 3-methyl-5-nitro-2-oxidanidyl-isoquinolin-2-ium Openeye Name: 3-methyl-5-nitro-2-oxido-isoquinolin-2-ium CAS Name: 3-methyl-5-nitro-2-oxidoisoquinolin-2-ium IUPAC Name: 3-methyl-5-nitro-2-oxidoisoquinolin-2-ium Traditional Name: 3-methyl-5-nitro-2-oxido-isoquinolin-2-ium Formula: C10H8N2O3 MolecularWeight: 204.18212

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](C=C2C=CC=C(C2=C1)[N+](=O)[O-])[O-]

Isomeric SMILES

CC1=[N+](C=C2C=CC=C(C2=C1)[N+](=O)[O-])[O-]

InChI

InChI=1S/C10H8N2O3/c1-7-5-9-8(6-11(7)13)3-2-4-10(9)12(14)15/h2-6H,1H3