3-[(3,4-dichlorophenyl)methyl]-6-methoxy-4-oxidanylidene-phthalazine-1-carboxylic acid

Systemtic Name: 3-[(3,4-dichlorophenyl)methyl]-6-methoxy-4-oxidanylidene-phthalazine-1-carboxylic acid Openeye Name: 3-[(3,4-dichlorophenyl)methyl]-6-methoxy-4-oxo-phthalazine-1-carboxylic acid CAS Name: 3-[(3,4-dichlorophenyl)methyl]-6-methoxy-4-oxo-1-phthalazinecarboxylic acid IUPAC Name: 3-[(3,4-dichlorophenyl)methyl]-6-methoxy-4-oxophthalazine-1-carboxylic acid Traditional Name: 3-(3,4-dichlorobenzyl)-4-keto-6-methoxy-phthalazine-1-carboxylic acid Formula: C17H12Cl2N2O4 MolecularWeight: 379.19418

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=NN(C2=O)CC3=CC(=C(C=C3)Cl)Cl)C(=O)O

Isomeric SMILES

COC1=CC2=C(C=C1)C(=NN(C2=O)CC3=CC(=C(C=C3)Cl)Cl)C(=O)O

InChI

InChI=1S/C17H12Cl2N2O4/c1-25-10-3-4-11-12(7-10)16(22)21(20-15(11)17(23)24)8-9-2-5-13(18)14(19)6-9/h2-7H,8H2,1H3,(H,23,24)