N-cyclopropyl-N-[(2,5-dimethoxyphenyl)methyl]-4-oxidanylidene-3-phenyl-phthalazine-1-carboxamide

Systemtic Name: N-cyclopropyl-N-[(2,5-dimethoxyphenyl)methyl]-4-oxidanylidene-3-phenyl-phthalazine-1-carboxamide Openeye Name: N-cyclopropyl-N-[(2,5-dimethoxyphenyl)methyl]-4-oxo-3-phenyl-phthalazine-1-carboxamide CAS Name: N-cyclopropyl-N-[(2,5-dimethoxyphenyl)methyl]-4-oxo-3-phenyl-1-phthalazinecarboxamide IUPAC Name: N-cyclopropyl-N-[(2,5-dimethoxyphenyl)methyl]-4-oxo-3-phenylphthalazine-1-carboxamide Traditional Name: N-cyclopropyl-N-(2,5-dimethoxybenzyl)-4-keto-3-phenyl-phthalazine-1-carboxamide Formula: C27H25N3O4 MolecularWeight: 455.5051

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)CN(C2CC2)C(=O)C3=NN(C(=O)C4=CC=CC=C43)C5=CC=CC=C5

Isomeric SMILES

COC1=CC(=C(C=C1)OC)CN(C2CC2)C(=O)C3=NN(C(=O)C4=CC=CC=C43)C5=CC=CC=C5

InChI

InChI=1S/C27H25N3O4/c1-33-21-14-15-24(34-2)18(16-21)17-29(19-12-13-19)27(32)25-22-10-6-7-11-23(22)26(31)30(28-25)20-8-4-3-5-9-20/h3-11,14-16,19H,12-13,17H2,1-2H3