3-methyl-4-oxidanylidene-N-[(Z)-(2-prop-2-ynoxyphenyl)methylideneamino]phthalazine-1-carboxamide

Systemtic Name: 3-methyl-4-oxidanylidene-N-[(Z)-(2-prop-2-ynoxyphenyl)methylideneamino]phthalazine-1-carboxamide Openeye Name: 3-methyl-4-oxo-N-[(Z)-(2-prop-2-ynoxyphenyl)methyleneamino]phthalazine-1-carboxamide CAS Name: 3-methyl-4-oxo-N-[(Z)-(2-prop-2-ynoxyphenyl)methylideneamino]-1-phthalazinecarboxamide IUPAC Name: 3-methyl-4-oxo-N-[(Z)-(2-prop-2-ynoxyphenyl)methylideneamino]phthalazine-1-carboxamide Traditional Name: 4-keto-3-methyl-N-[(Z)-(2-propargyloxybenzylidene)amino]phthalazine-1-carboxamide Formula: C20H16N4O3 MolecularWeight: 360.36604

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NN=CC3=CC=CC=C3OCC#C

Isomeric SMILES

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N/N=C\C3=CC=CC=C3OCC#C

InChI

InChI=1S/C20H16N4O3/c1-3-12-27-17-11-7-4-8-14(17)13-21-22-19(25)18-15-9-5-6-10-16(15)20(26)24(2)23-18/h1,4-11,13H,12H2,2H3,(H,22,25)/b21-13-