2-(3,5-dimethylphenoxy)ethyl 2-[1,4-bis(oxidanylidene)-3H-phthalazin-2-yl]ethanoate

Systemtic Name: 2-(3,5-dimethylphenoxy)ethyl 2-[1,4-bis(oxidanylidene)-3H-phthalazin-2-yl]ethanoate Openeye Name: 2-(3,5-dimethylphenoxy)ethyl 2-(1,4-dioxo-3H-phthalazin-2-yl)acetate CAS Name: 2-(1,4-dioxo-3H-phthalazin-2-yl)acetic acid 2-(3,5-dimethylphenoxy)ethyl ester IUPAC Name: 2-(3,5-dimethylphenoxy)ethyl 2-(1,4-dioxo-3H-phthalazin-2-yl)acetate Traditional Name: 2-(1,4-diketo-3H-phthalazin-2-yl)acetic acid 2-(3,5-dimethylphenoxy)ethyl ester Formula: C20H20N2O5 MolecularWeight: 368.3832

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OCCOC(=O)CN2C(=O)C3=CC=CC=C3C(=O)N2)C

Isomeric SMILES

CC1=CC(=CC(=C1)OCCOC(=O)CN2C(=O)C3=CC=CC=C3C(=O)N2)C

InChI

InChI=1S/C20H20N2O5/c1-13-9-14(2)11-15(10-13)26-7-8-27-18(23)12-22-20(25)17-6-4-3-5-16(17)19(24)21-22/h3-6,9-11H,7-8,12H2,1-2H3,(H,21,24)