N-(1,3-benzodioxol-5-ylmethyl)-N-ethyl-4-oxidanylidene-3-phenyl-phthalazine-1-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-N-ethyl-4-oxidanylidene-3-phenyl-phthalazine-1-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-N-ethyl-4-oxo-3-phenyl-phthalazine-1-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-N-ethyl-4-oxo-3-phenyl-1-phthalazinecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-N-ethyl-4-oxo-3-phenylphthalazine-1-carboxamide Traditional Name: N-ethyl-4-keto-3-phenyl-N-piperonyl-phthalazine-1-carboxamide Formula: C25H21N3O4 MolecularWeight: 427.45194

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC2=C(C=C1)OCO2)C(=O)C3=NN(C(=O)C4=CC=CC=C43)C5=CC=CC=C5

Isomeric SMILES

CCN(CC1=CC2=C(C=C1)OCO2)C(=O)C3=NN(C(=O)C4=CC=CC=C43)C5=CC=CC=C5

InChI

InChI=1S/C25H21N3O4/c1-2-27(15-17-12-13-21-22(14-17)32-16-31-21)25(30)23-19-10-6-7-11-20(19)24(29)28(26-23)18-8-4-3-5-9-18/h3-14H,2,15-16H2,1H3