[1-oxidanylidene-1-[(4-phenylmethoxyphenyl)amino]propan-2-yl] 3-methyl-4-oxidanylidene-phthalazine-1-carboxylate

Systemtic Name: [1-oxidanylidene-1-[(4-phenylmethoxyphenyl)amino]propan-2-yl] 3-methyl-4-oxidanylidene-phthalazine-1-carboxylate Openeye Name: [2-(4-benzyloxyanilino)-1-methyl-2-oxo-ethyl] 3-methyl-4-oxo-phthalazine-1-carboxylate CAS Name: 3-methyl-4-oxo-1-phthalazinecarboxylic acid [1-oxo-1-(4-phenylmethoxyanilino)propan-2-yl] ester IUPAC Name: [1-oxo-1-(4-phenylmethoxyanilino)propan-2-yl] 3-methyl-4-oxophthalazine-1-carboxylate Traditional Name: 4-keto-3-methyl-phthalazine-1-carboxylic acid [2-(4-benzoxyanilino)-2-keto-1-methyl-ethyl] ester Formula: C26H23N3O5 MolecularWeight: 457.47792

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)OCC2=CC=CC=C2)OC(=O)C3=NN(C(=O)C4=CC=CC=C43)C

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)OCC2=CC=CC=C2)OC(=O)C3=NN(C(=O)C4=CC=CC=C43)C

InChI

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