ethyl 2-[3-[2-[(4-ethoxyphenyl)amino]-2-oxidanylidene-ethyl]-4-oxidanylidene-phthalazin-1-yl]ethanoate

Systemtic Name: ethyl 2-[3-[2-[(4-ethoxyphenyl)amino]-2-oxidanylidene-ethyl]-4-oxidanylidene-phthalazin-1-yl]ethanoate Openeye Name: ethyl 2-[3-[2-(4-ethoxyanilino)-2-oxo-ethyl]-4-oxo-phthalazin-1-yl]acetate CAS Name: 2-[3-[2-(4-ethoxyanilino)-2-oxoethyl]-4-oxo-1-phthalazinyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[3-[2-(4-ethoxyanilino)-2-oxoethyl]-4-oxophthalazin-1-yl]acetate Traditional Name: 2-[4-keto-3-[2-keto-2-(p-phenetidino)ethyl]phthalazin-1-yl]acetic acid ethyl ester Formula: C22H23N3O5 MolecularWeight: 409.43512

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)CN2C(=O)C3=CC=CC=C3C(=N2)CC(=O)OCC

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)CN2C(=O)C3=CC=CC=C3C(=N2)CC(=O)OCC

InChI

InChI=1S/C22H23N3O5/c1-3-29-16-11-9-15(10-12-16)23-20(26)14-25-22(28)18-8-6-5-7-17(18)19(24-25)13-21(27)30-4-2/h5-12H,3-4,13-14H2,1-2H3,(H,23,26)