3-[2-(4-methylphenoxy)ethyl]-4-oxidanylidene-phthalazine-1-carboxylic acid

Systemtic Name: 3-[2-(4-methylphenoxy)ethyl]-4-oxidanylidene-phthalazine-1-carboxylic acid Openeye Name: 3-[2-(4-methylphenoxy)ethyl]-4-oxo-phthalazine-1-carboxylic acid CAS Name: 3-[2-(4-methylphenoxy)ethyl]-4-oxo-1-phthalazinecarboxylic acid IUPAC Name: 3-[2-(4-methylphenoxy)ethyl]-4-oxophthalazine-1-carboxylic acid Traditional Name: 4-keto-3-[2-(4-methylphenoxy)ethyl]phthalazine-1-carboxylic acid Formula: C18H16N2O4 MolecularWeight: 324.33064

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OCCN2C(=O)C3=CC=CC=C3C(=N2)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)OCCN2C(=O)C3=CC=CC=C3C(=N2)C(=O)O

InChI

InChI=1S/C18H16N2O4/c1-12-6-8-13(9-7-12)24-11-10-20-17(21)15-5-3-2-4-14(15)16(19-20)18(22)23/h2-9H,10-11H2,1H3,(H,22,23)