N-[4-methoxy-3-(pyridin-3-ylmethoxy)phenyl]-4-oxidanylidene-3-phenyl-phthalazine-1-carboxamide

Systemtic Name: N-[4-methoxy-3-(pyridin-3-ylmethoxy)phenyl]-4-oxidanylidene-3-phenyl-phthalazine-1-carboxamide Openeye Name: N-[4-methoxy-3-(3-pyridylmethoxy)phenyl]-4-oxo-3-phenyl-phthalazine-1-carboxamide CAS Name: N-[4-methoxy-3-(3-pyridinylmethoxy)phenyl]-4-oxo-3-phenyl-1-phthalazinecarboxamide IUPAC Name: N-[4-methoxy-3-(pyridin-3-ylmethoxy)phenyl]-4-oxo-3-phenylphthalazine-1-carboxamide Traditional Name: 4-keto-N-[4-methoxy-3-(3-pyridylmethoxy)phenyl]-3-phenyl-phthalazine-1-carboxamide Formula: C28H22N4O4 MolecularWeight: 478.49868

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)C2=NN(C(=O)C3=CC=CC=C32)C4=CC=CC=C4)OCC5=CN=CC=C5

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)C2=NN(C(=O)C3=CC=CC=C32)C4=CC=CC=C4)OCC5=CN=CC=C5

InChI

InChI=1S/C28H22N4O4/c1-35-24-14-13-20(16-25(24)36-18-19-8-7-15-29-17-19)30-27(33)26-22-11-5-6-12-23(22)28(34)32(31-26)21-9-3-2-4-10-21/h2-17H,18H2,1H3,(H,30,33)