3-ethyl-4-oxidanylidene-N-[(E)-1-(4-propoxyphenyl)ethylideneamino]phthalazine-1-carboxamide

Systemtic Name: 3-ethyl-4-oxidanylidene-N-[(E)-1-(4-propoxyphenyl)ethylideneamino]phthalazine-1-carboxamide Openeye Name: 3-ethyl-4-oxo-N-[(E)-1-(4-propoxyphenyl)ethylideneamino]phthalazine-1-carboxamide CAS Name: 3-ethyl-4-oxo-N-[(E)-1-(4-propoxyphenyl)ethylideneamino]-1-phthalazinecarboxamide IUPAC Name: 3-ethyl-4-oxo-N-[(E)-1-(4-propoxyphenyl)ethylideneamino]phthalazine-1-carboxamide Traditional Name: 3-ethyl-4-keto-N-[(E)-1-(4-propoxyphenyl)ethylideneamino]phthalazine-1-carboxamide Formula: C22H24N4O3 MolecularWeight: 392.45096

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C(=NNC(=O)C2=NN(C(=O)C3=CC=CC=C32)CC)C

Isomeric SMILES

CCCOC1=CC=C(C=C1)/C(=N/NC(=O)C2=NN(C(=O)C3=CC=CC=C32)CC)/C

InChI

InChI=1S/C22H24N4O3/c1-4-14-29-17-12-10-16(11-13-17)15(3)23-24-21(27)20-18-8-6-7-9-19(18)22(28)26(5-2)25-20/h6-13H,4-5,14H2,1-3H3,(H,24,27)/b23-15+