[4-[2-(3-methyl-4-oxidanylidene-phthalazin-1-yl)ethanoylamino]phenyl] 2-methoxybenzoate

Systemtic Name: [4-[2-(3-methyl-4-oxidanylidene-phthalazin-1-yl)ethanoylamino]phenyl] 2-methoxybenzoate Openeye Name: [4-[[2-(3-methyl-4-oxo-phthalazin-1-yl)acetyl]amino]phenyl] 2-methoxybenzoate CAS Name: 2-methoxybenzoic acid [4-[[2-(3-methyl-4-oxo-1-phthalazinyl)-1-oxoethyl]amino]phenyl] ester IUPAC Name: [4-[[2-(3-methyl-4-oxophthalazin-1-yl)acetyl]amino]phenyl] 2-methoxybenzoate Traditional Name: 2-methoxybenzoic acid [4-[[2-(4-keto-3-methyl-phthalazin-1-yl)acetyl]amino]phenyl] ester Formula: C25H21N3O5 MolecularWeight: 443.45134

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=CC=CC=C2C(=N1)CC(=O)NC3=CC=C(C=C3)OC(=O)C4=CC=CC=C4OC

Isomeric SMILES

CN1C(=O)C2=CC=CC=C2C(=N1)CC(=O)NC3=CC=C(C=C3)OC(=O)C4=CC=CC=C4OC

InChI

InChI=1S/C25H21N3O5/c1-28-24(30)19-8-4-3-7-18(19)21(27-28)15-23(29)26-16-11-13-17(14-12-16)33-25(31)20-9-5-6-10-22(20)32-2/h3-14H,15H2,1-2H3,(H,26,29)