methyl 2-[4-[2-[4-(4-methylphenyl)-1-oxidanylidene-phthalazin-2-yl]ethanoylamino]phenoxy]ethanoate

Systemtic Name: methyl 2-[4-[2-[4-(4-methylphenyl)-1-oxidanylidene-phthalazin-2-yl]ethanoylamino]phenoxy]ethanoate Openeye Name: methyl 2-[4-[[2-[1-oxo-4-(p-tolyl)phthalazin-2-yl]acetyl]amino]phenoxy]acetate CAS Name: 2-[4-[[2-[4-(4-methylphenyl)-1-oxo-2-phthalazinyl]-1-oxoethyl]amino]phenoxy]acetic acid methyl ester IUPAC Name: methyl 2-[4-[[2-[4-(4-methylphenyl)-1-oxophthalazin-2-yl]acetyl]amino]phenoxy]acetate Traditional Name: 2-[4-[[2-[1-keto-4-(p-tolyl)phthalazin-2-yl]acetyl]amino]phenoxy]acetic acid methyl ester Formula: C26H23N3O5 MolecularWeight: 457.47792

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN(C(=O)C3=CC=CC=C32)CC(=O)NC4=CC=C(C=C4)OCC(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN(C(=O)C3=CC=CC=C32)CC(=O)NC4=CC=C(C=C4)OCC(=O)OC

InChI

InChI=1S/C26H23N3O5/c1-17-7-9-18(10-8-17)25-21-5-3-4-6-22(21)26(32)29(28-25)15-23(30)27-19-11-13-20(14-12-19)34-16-24(31)33-2/h3-14H,15-16H2,1-2H3,(H,27,30)