[1-[(6-chloranyl-4H-1,3-benzodioxin-8-yl)methyl]pyridin-1-ium-4-yl]-phenyl-methanone

Systemtic Name: [1-[(6-chloranyl-4H-1,3-benzodioxin-8-yl)methyl]pyridin-1-ium-4-yl]-phenyl-methanone Openeye Name: [1-[(6-chloro-4H-1,3-benzodioxin-8-yl)methyl]pyridin-1-ium-4-yl]-phenyl-methanone CAS Name: [1-[(6-chloro-4H-1,3-benzodioxin-8-yl)methyl]-4-pyridin-1-iumyl]-phenylmethanone IUPAC Name: [1-[(6-chloro-4H-1,3-benzodioxin-8-yl)methyl]pyridin-1-ium-4-yl]-phenylmethanone Traditional Name: [1-[(6-chloro-4H-1,3-benzodioxin-8-yl)methyl]pyridin-1-ium-4-yl]-phenyl-methanone Formula: C21H17ClNO3+ MolecularWeight: 366.81758

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC(=CC(=C2OCO1)C[N+]3=CC=C(C=C3)C(=O)C4=CC=CC=C4)Cl

Isomeric SMILES

C1C2=CC(=CC(=C2OCO1)C[N+]3=CC=C(C=C3)C(=O)C4=CC=CC=C4)Cl

InChI

InChI=1S/C21H17ClNO3/c22-19-10-17(21-18(11-19)13-25-14-26-21)12-23-8-6-16(7-9-23)20(24)15-4-2-1-3-5-15/h1-11H,12-14H2/q+1