N-(3-nitrophenyl)-4-oxidanylidene-3-propyl-phthalazine-1-carboxamide

Systemtic Name: N-(3-nitrophenyl)-4-oxidanylidene-3-propyl-phthalazine-1-carboxamide Openeye Name: N-(3-nitrophenyl)-4-oxo-3-propyl-phthalazine-1-carboxamide CAS Name: N-(3-nitrophenyl)-4-oxo-3-propyl-1-phthalazinecarboxamide IUPAC Name: N-(3-nitrophenyl)-4-oxo-3-propylphthalazine-1-carboxamide Traditional Name: 4-keto-N-(3-nitrophenyl)-3-propyl-phthalazine-1-carboxamide Formula: C18H16N4O4 MolecularWeight: 352.34404

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H16N4O4/c1-2-10-21-18(24)15-9-4-3-8-14(15)16(20-21)17(23)19-12-6-5-7-13(11-12)22(25)26/h3-9,11H,2,10H2,1H3,(H,19,23)