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

Systemtic Name: ethyl 2-[[3-(4-ethoxyphenyl)-4-oxidanylidene-phthalazin-1-yl]carbonylamino]ethanoate Openeye Name: ethyl 2-[[3-(4-ethoxyphenyl)-4-oxo-phthalazine-1-carbonyl]amino]acetate CAS Name: 2-[[[3-(4-ethoxyphenyl)-4-oxo-1-phthalazinyl]-oxomethyl]amino]acetic acid ethyl ester IUPAC Name: ethyl 2-[[3-(4-ethoxyphenyl)-4-oxophthalazine-1-carbonyl]amino]acetate Traditional Name: 2-[(4-keto-3-p-phenetyl-phthalazine-1-carbonyl)amino]acetic acid ethyl ester Formula: C21H21N3O5 MolecularWeight: 395.40854

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3C(=N2)C(=O)NCC(=O)OCC

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3C(=N2)C(=O)NCC(=O)OCC

InChI

InChI=1S/C21H21N3O5/c1-3-28-15-11-9-14(10-12-15)24-21(27)17-8-6-5-7-16(17)19(23-24)20(26)22-13-18(25)29-4-2/h5-12H,3-4,13H2,1-2H3,(H,22,26)