1-chloranyl-4-[(1-oxidanidylpyridin-1-ium-4-yl)methyl]phthalazine

Systemtic Name: 1-chloranyl-4-[(1-oxidanidylpyridin-1-ium-4-yl)methyl]phthalazine Openeye Name: 1-chloro-4-[(1-oxidopyridin-1-ium-4-yl)methyl]phthalazine CAS Name: 1-chloro-4-[(1-oxido-4-pyridin-1-iumyl)methyl]phthalazine IUPAC Name: 1-chloro-4-[(1-oxidopyridin-1-ium-4-yl)methyl]phthalazine Traditional Name: 1-chloro-4-[(1-oxidopyridin-1-ium-4-yl)methyl]phthalazine Formula: C14H10ClN3O MolecularWeight: 271.7017

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NN=C2Cl)CC3=CC=[N+](C=C3)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=NN=C2Cl)CC3=CC=[N+](C=C3)[O-]

InChI

InChI=1S/C14H10ClN3O/c15-14-12-4-2-1-3-11(12)13(16-17-14)9-10-5-7-18(19)8-6-10/h1-8H,9H2