4-oxidanylidene-3-propan-2-yl-N-[(Z)-(4-propoxyphenyl)methylideneamino]phthalazine-1-carboxamide

Systemtic Name: 4-oxidanylidene-3-propan-2-yl-N-[(Z)-(4-propoxyphenyl)methylideneamino]phthalazine-1-carboxamide Openeye Name: 3-isopropyl-4-oxo-N-[(Z)-(4-propoxyphenyl)methyleneamino]phthalazine-1-carboxamide CAS Name: 4-oxo-3-propan-2-yl-N-[(Z)-(4-propoxyphenyl)methylideneamino]-1-phthalazinecarboxamide IUPAC Name: 4-oxo-3-propan-2-yl-N-[(Z)-(4-propoxyphenyl)methylideneamino]phthalazine-1-carboxamide Traditional Name: 3-isopropyl-4-keto-N-[(Z)-(4-propoxybenzylidene)amino]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)C(C)C

Isomeric SMILES

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

InChI

InChI=1S/C22H24N4O3/c1-4-13-29-17-11-9-16(10-12-17)14-23-24-21(27)20-18-7-5-6-8-19(18)22(28)26(25-20)15(2)3/h5-12,14-15H,4,13H2,1-3H3,(H,24,27)/b23-14-