(E)-3-(4-nitrophenyl)-N-[(4-oxidanylidene-3H-phthalazin-1-yl)methyl]prop-2-enamide

Systemtic Name: (E)-3-(4-nitrophenyl)-N-[(4-oxidanylidene-3H-phthalazin-1-yl)methyl]prop-2-enamide Openeye Name: (E)-3-(4-nitrophenyl)-N-[(4-oxo-3H-phthalazin-1-yl)methyl]prop-2-enamide CAS Name: (E)-3-(4-nitrophenyl)-N-[(4-oxo-3H-phthalazin-1-yl)methyl]-2-propenamide IUPAC Name: (E)-3-(4-nitrophenyl)-N-[(4-oxo-3H-phthalazin-1-yl)methyl]prop-2-enamide Traditional Name: (E)-N-[(4-keto-3H-phthalazin-1-yl)methyl]-3-(4-nitrophenyl)acrylamide Formula: C18H14N4O4 MolecularWeight: 350.32816

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NNC2=O)CNC(=O)C=CC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=NNC2=O)CNC(=O)/C=C/C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H14N4O4/c23-17(10-7-12-5-8-13(9-6-12)22(25)26)19-11-16-14-3-1-2-4-15(14)18(24)21-20-16/h1-10H,11H2,(H,19,23)(H,21,24)/b10-7+