methyl 4-[2-[1,4-bis(oxidanylidene)-3H-phthalazin-2-yl]ethanoylamino]benzoate

Systemtic Name: methyl 4-[2-[1,4-bis(oxidanylidene)-3H-phthalazin-2-yl]ethanoylamino]benzoate Openeye Name: methyl 4-[[2-(1,4-dioxo-3H-phthalazin-2-yl)acetyl]amino]benzoate CAS Name: 4-[[2-(1,4-dioxo-3H-phthalazin-2-yl)-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-(1,4-dioxo-3H-phthalazin-2-yl)acetyl]amino]benzoate Traditional Name: 4-[[2-(1,4-diketo-3H-phthalazin-2-yl)acetyl]amino]benzoic acid methyl ester Formula: C18H15N3O5 MolecularWeight: 353.3288

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H15N3O5/c1-26-18(25)11-6-8-12(9-7-11)19-15(22)10-21-17(24)14-5-3-2-4-13(14)16(23)20-21/h2-9H,10H2,1H3,(H,19,22)(H,20,23)