[3-[2-(3-methyl-4-oxidanylidene-phthalazin-1-yl)ethanoylamino]phenyl] (E)-3-phenylprop-2-enoate

Systemtic Name: [3-[2-(3-methyl-4-oxidanylidene-phthalazin-1-yl)ethanoylamino]phenyl] (E)-3-phenylprop-2-enoate Openeye Name: [3-[[2-(3-methyl-4-oxo-phthalazin-1-yl)acetyl]amino]phenyl] (E)-3-phenylprop-2-enoate CAS Name: (E)-3-phenyl-2-propenoic acid [3-[[2-(3-methyl-4-oxo-1-phthalazinyl)-1-oxoethyl]amino]phenyl] ester IUPAC Name: [3-[[2-(3-methyl-4-oxophthalazin-1-yl)acetyl]amino]phenyl] (E)-3-phenylprop-2-enoate Traditional Name: (E)-3-phenylacrylic acid [3-[[2-(4-keto-3-methyl-phthalazin-1-yl)acetyl]amino]phenyl] ester Formula: C26H21N3O4 MolecularWeight: 439.46264

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=CC=CC=C2C(=N1)CC(=O)NC3=CC(=CC=C3)OC(=O)C=CC4=CC=CC=C4

Isomeric SMILES

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

InChI

InChI=1S/C26H21N3O4/c1-29-26(32)22-13-6-5-12-21(22)23(28-29)17-24(30)27-19-10-7-11-20(16-19)33-25(31)15-14-18-8-3-2-4-9-18/h2-16H,17H2,1H3,(H,27,30)/b15-14+