methyl 2-[3-[[4-oxidanylidene-3-(phenylmethyl)phthalazin-1-yl]carbonylamino]phenoxy]ethanoate

Systemtic Name: methyl 2-[3-[[4-oxidanylidene-3-(phenylmethyl)phthalazin-1-yl]carbonylamino]phenoxy]ethanoate Openeye Name: methyl 2-[3-[(3-benzyl-4-oxo-phthalazine-1-carbonyl)amino]phenoxy]acetate CAS Name: 2-[3-[[oxo-[4-oxo-3-(phenylmethyl)-1-phthalazinyl]methyl]amino]phenoxy]acetic acid methyl ester IUPAC Name: methyl 2-[3-[(3-benzyl-4-oxophthalazine-1-carbonyl)amino]phenoxy]acetate Traditional Name: 2-[3-[(3-benzyl-4-keto-phthalazine-1-carbonyl)amino]phenoxy]acetic acid methyl ester Formula: C25H21N3O5 MolecularWeight: 443.45134

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)COC1=CC=CC(=C1)NC(=O)C2=NN(C(=O)C3=CC=CC=C32)CC4=CC=CC=C4

Isomeric SMILES

COC(=O)COC1=CC=CC(=C1)NC(=O)C2=NN(C(=O)C3=CC=CC=C32)CC4=CC=CC=C4

InChI

InChI=1S/C25H21N3O5/c1-32-22(29)16-33-19-11-7-10-18(14-19)26-24(30)23-20-12-5-6-13-21(20)25(31)28(27-23)15-17-8-3-2-4-9-17/h2-14H,15-16H2,1H3,(H,26,30)