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

Systemtic Name: N-[(Z)-(2-ethoxyphenyl)methylideneamino]-4-oxidanylidene-3-propan-2-yl-phthalazine-1-carboxamide Openeye Name: N-[(Z)-(2-ethoxyphenyl)methyleneamino]-3-isopropyl-4-oxo-phthalazine-1-carboxamide CAS Name: N-[(Z)-(2-ethoxyphenyl)methylideneamino]-4-oxo-3-propan-2-yl-1-phthalazinecarboxamide IUPAC Name: N-[(Z)-(2-ethoxyphenyl)methylideneamino]-4-oxo-3-propan-2-ylphthalazine-1-carboxamide Traditional Name: N-[(Z)-(2-ethoxybenzylidene)amino]-3-isopropyl-4-keto-phthalazine-1-carboxamide Formula: C21H22N4O3 MolecularWeight: 378.42438

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1C=NNC(=O)C2=NN(C(=O)C3=CC=CC=C32)C(C)C

Isomeric SMILES

CCOC1=CC=CC=C1/C=N\NC(=O)C2=NN(C(=O)C3=CC=CC=C32)C(C)C

InChI

InChI=1S/C21H22N4O3/c1-4-28-18-12-8-5-9-15(18)13-22-23-20(26)19-16-10-6-7-11-17(16)21(27)25(24-19)14(2)3/h5-14H,4H2,1-3H3,(H,23,26)/b22-13-