4-[[3,5-bis(chloranyl)pyridin-4-yl]methyl]-7-methoxy-phthalazine-1-carboxylic acid

Systemtic Name: 4-[[3,5-bis(chloranyl)pyridin-4-yl]methyl]-7-methoxy-phthalazine-1-carboxylic acid Openeye Name: 4-[(3,5-dichloro-4-pyridyl)methyl]-7-methoxy-phthalazine-1-carboxylic acid CAS Name: 4-[(3,5-dichloro-4-pyridinyl)methyl]-7-methoxy-1-phthalazinecarboxylic acid IUPAC Name: 4-[(3,5-dichloropyridin-4-yl)methyl]-7-methoxyphthalazine-1-carboxylic acid Traditional Name: 4-[(3,5-dichloro-4-pyridyl)methyl]-7-methoxy-phthalazine-1-carboxylic acid Formula: C16H11Cl2N3O3 MolecularWeight: 364.18284

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=NN=C2C(=O)O)CC3=C(C=NC=C3Cl)Cl

Isomeric SMILES

COC1=CC2=C(C=C1)C(=NN=C2C(=O)O)CC3=C(C=NC=C3Cl)Cl

InChI

InChI=1S/C16H11Cl2N3O3/c1-24-8-2-3-9-10(4-8)15(16(22)23)21-20-14(9)5-11-12(17)6-19-7-13(11)18/h2-4,6-7H,5H2,1H3,(H,22,23)