N-[1-(3,4-diethoxyphenyl)ethyl]-4-oxidanylidene-3-phenyl-phthalazine-1-carboxamide

Systemtic Name: N-[1-(3,4-diethoxyphenyl)ethyl]-4-oxidanylidene-3-phenyl-phthalazine-1-carboxamide Openeye Name: N-[1-(3,4-diethoxyphenyl)ethyl]-4-oxo-3-phenyl-phthalazine-1-carboxamide CAS Name: N-[1-(3,4-diethoxyphenyl)ethyl]-4-oxo-3-phenyl-1-phthalazinecarboxamide IUPAC Name: N-[1-(3,4-diethoxyphenyl)ethyl]-4-oxo-3-phenylphthalazine-1-carboxamide Traditional Name: N-[1-(3,4-diethoxyphenyl)ethyl]-4-keto-3-phenyl-phthalazine-1-carboxamide Formula: C27H27N3O4 MolecularWeight: 457.52098

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(C)NC(=O)C2=NN(C(=O)C3=CC=CC=C32)C4=CC=CC=C4)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(C)NC(=O)C2=NN(C(=O)C3=CC=CC=C32)C4=CC=CC=C4)OCC

InChI

InChI=1S/C27H27N3O4/c1-4-33-23-16-15-19(17-24(23)34-5-2)18(3)28-26(31)25-21-13-9-10-14-22(21)27(32)30(29-25)20-11-7-6-8-12-20/h6-18H,4-5H2,1-3H3,(H,28,31)