[2-[2-[ethyl-(3-methylphenyl)amino]ethylamino]-2-oxidanylidene-ethyl] 4-oxidanylidene-3H-phthalazine-1-carboxylate

Systemtic Name: [2-[2-[ethyl-(3-methylphenyl)amino]ethylamino]-2-oxidanylidene-ethyl] 4-oxidanylidene-3H-phthalazine-1-carboxylate Openeye Name: [2-[2-(N-ethyl-3-methyl-anilino)ethylamino]-2-oxo-ethyl] 4-oxo-3H-phthalazine-1-carboxylate CAS Name: 4-oxo-3H-phthalazine-1-carboxylic acid [2-[2-(N-ethyl-3-methylanilino)ethylamino]-2-oxoethyl] ester IUPAC Name: [2-[2-(N-ethyl-3-methylanilino)ethylamino]-2-oxoethyl] 4-oxo-3H-phthalazine-1-carboxylate Traditional Name: 4-keto-3H-phthalazine-1-carboxylic acid [2-[2-(N-ethyl-3-methyl-anilino)ethylamino]-2-keto-ethyl] ester Formula: C22H24N4O4 MolecularWeight: 408.45036

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCNC(=O)COC(=O)C1=NNC(=O)C2=CC=CC=C21)C3=CC=CC(=C3)C

Isomeric SMILES

CCN(CCNC(=O)COC(=O)C1=NNC(=O)C2=CC=CC=C21)C3=CC=CC(=C3)C

InChI

InChI=1S/C22H24N4O4/c1-3-26(16-8-6-7-15(2)13-16)12-11-23-19(27)14-30-22(29)20-17-9-4-5-10-18(17)21(28)25-24-20/h4-10,13H,3,11-12,14H2,1-2H3,(H,23,27)(H,25,28)