2-[(6-chloranyl-4H-1,3-benzodioxin-8-yl)methyl]isoquinolin-2-ium

Systemtic Name: 2-[(6-chloranyl-4H-1,3-benzodioxin-8-yl)methyl]isoquinolin-2-ium Openeye Name: 2-[(6-chloro-4H-1,3-benzodioxin-8-yl)methyl]isoquinolin-2-ium CAS Name: 2-[(6-chloro-4H-1,3-benzodioxin-8-yl)methyl]isoquinolin-2-ium IUPAC Name: 2-[(6-chloro-4H-1,3-benzodioxin-8-yl)methyl]isoquinolin-2-ium Traditional Name: 2-[(6-chloro-4H-1,3-benzodioxin-8-yl)methyl]isoquinolin-2-ium Formula: C18H15ClNO2+ MolecularWeight: 312.7702

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC(=CC(=C2OCO1)C[N+]3=CC4=CC=CC=C4C=C3)Cl

Isomeric SMILES

C1C2=CC(=CC(=C2OCO1)C[N+]3=CC4=CC=CC=C4C=C3)Cl

InChI

InChI=1S/C18H15ClNO2/c19-17-7-15(18-16(8-17)11-21-12-22-18)10-20-6-5-13-3-1-2-4-14(13)9-20/h1-9H,10-12H2/q+1