N-[(E)-(2-ethoxyphenyl)methylideneamino]-4-oxidanylidene-3-propyl-phthalazine-1-carboxamide

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NN=CC3=CC=CC=C3OCC

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N/N=C/C3=CC=CC=C3OCC

InChI

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