methyl 4,5-dimethoxy-2-[[4-oxidanylidene-3-(phenylmethyl)phthalazin-1-yl]carbonylamino]benzoate

Systemtic Name: methyl 4,5-dimethoxy-2-[[4-oxidanylidene-3-(phenylmethyl)phthalazin-1-yl]carbonylamino]benzoate Openeye Name: methyl 2-[(3-benzyl-4-oxo-phthalazine-1-carbonyl)amino]-4,5-dimethoxy-benzoate CAS Name: 4,5-dimethoxy-2-[[oxo-[4-oxo-3-(phenylmethyl)-1-phthalazinyl]methyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[(3-benzyl-4-oxophthalazine-1-carbonyl)amino]-4,5-dimethoxybenzoate Traditional Name: 2-[(3-benzyl-4-keto-phthalazine-1-carbonyl)amino]-4,5-dimethoxy-benzoic acid methyl ester Formula: C26H23N3O6 MolecularWeight: 473.47732

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H23N3O6/c1-33-21-13-19(26(32)35-3)20(14-22(21)34-2)27-24(30)23-17-11-7-8-12-18(17)25(31)29(28-23)15-16-9-5-4-6-10-16/h4-14H,15H2,1-3H3,(H,27,30)