N-[(Z)-1-(2-nitrophenyl)ethylideneamino]-4-oxidanylidene-3-propyl-phthalazine-1-carboxamide

Systemtic Name: N-[(Z)-1-(2-nitrophenyl)ethylideneamino]-4-oxidanylidene-3-propyl-phthalazine-1-carboxamide Openeye Name: N-[(Z)-1-(2-nitrophenyl)ethylideneamino]-4-oxo-3-propyl-phthalazine-1-carboxamide CAS Name: N-[(Z)-1-(2-nitrophenyl)ethylideneamino]-4-oxo-3-propyl-1-phthalazinecarboxamide IUPAC Name: N-[(Z)-1-(2-nitrophenyl)ethylideneamino]-4-oxo-3-propylphthalazine-1-carboxamide Traditional Name: 4-keto-N-[(Z)-1-(2-nitrophenyl)ethylideneamino]-3-propyl-phthalazine-1-carboxamide Formula: C20H19N5O4 MolecularWeight: 393.39596

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NN=C(C)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N/N=C(/C)\C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C20H19N5O4/c1-3-12-24-20(27)16-10-5-4-9-15(16)18(23-24)19(26)22-21-13(2)14-8-6-7-11-17(14)25(28)29/h4-11H,3,12H2,1-2H3,(H,22,26)/b21-13-