N-[(Z)-(5-nitrofuran-2-yl)methylideneamino]-4-oxidanylidene-3-propyl-phthalazine-1-carboxamide

Systemtic Name: N-[(Z)-(5-nitrofuran-2-yl)methylideneamino]-4-oxidanylidene-3-propyl-phthalazine-1-carboxamide Openeye Name: N-[(Z)-(5-nitro-2-furyl)methyleneamino]-4-oxo-3-propyl-phthalazine-1-carboxamide CAS Name: N-[(Z)-(5-nitro-2-furanyl)methylideneamino]-4-oxo-3-propyl-1-phthalazinecarboxamide IUPAC Name: N-[(Z)-(5-nitrofuran-2-yl)methylideneamino]-4-oxo-3-propylphthalazine-1-carboxamide Traditional Name: 4-keto-N-[(Z)-(5-nitro-2-furyl)methyleneamino]-3-propyl-phthalazine-1-carboxamide Formula: C17H15N5O5 MolecularWeight: 369.3315

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NN=CC3=CC=C(O3)[N+](=O)[O-]

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N/N=C\C3=CC=C(O3)[N+](=O)[O-]

InChI

InChI=1S/C17H15N5O5/c1-2-9-21-17(24)13-6-4-3-5-12(13)15(20-21)16(23)19-18-10-11-7-8-14(27-11)22(25)26/h3-8,10H,2,9H2,1H3,(H,19,23)/b18-10-