2-oxidanidyl-1-(phenylmethyl)isoquinolin-2-ium

Systemtic Name: 2-oxidanidyl-1-(phenylmethyl)isoquinolin-2-ium Openeye Name: 1-benzyl-2-oxido-isoquinolin-2-ium CAS Name: 2-oxido-1-(phenylmethyl)isoquinolin-2-ium IUPAC Name: 1-benzyl-2-oxidoisoquinolin-2-ium Traditional Name: 1-benzyl-2-oxido-isoquinolin-2-ium Formula: C16H13NO MolecularWeight: 235.28052

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=[N+](C=CC3=CC=CC=C32)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CC2=[N+](C=CC3=CC=CC=C32)[O-]

InChI

InChI=1S/C16H13NO/c18-17-11-10-14-8-4-5-9-15(14)16(17)12-13-6-2-1-3-7-13/h1-11H,12H2