N-(4-fluoranyl-3-nitro-phenyl)-1,3-bis(oxidanylidene)-2-prop-2-enyl-isoindole-5-carboxamide

Systemtic Name: N-(4-fluoranyl-3-nitro-phenyl)-1,3-bis(oxidanylidene)-2-prop-2-enyl-isoindole-5-carboxamide Openeye Name: 2-allyl-N-(4-fluoro-3-nitro-phenyl)-1,3-dioxo-isoindoline-5-carboxamide CAS Name: N-(4-fluoro-3-nitrophenyl)-1,3-dioxo-2-prop-2-enyl-5-isoindolecarboxamide IUPAC Name: N-(4-fluoro-3-nitrophenyl)-1,3-dioxo-2-prop-2-enylisoindole-5-carboxamide Traditional Name: 2-allyl-N-(4-fluoro-3-nitro-phenyl)-1,3-diketo-isoindoline-5-carboxamide Formula: C18H12FN3O5 MolecularWeight: 369.303383

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)NC3=CC(=C(C=C3)F)[N+](=O)[O-]

Isomeric SMILES

C=CCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)NC3=CC(=C(C=C3)F)[N+](=O)[O-]

InChI

InChI=1S/C18H12FN3O5/c1-2-7-21-17(24)12-5-3-10(8-13(12)18(21)25)16(23)20-11-4-6-14(19)15(9-11)22(26)27/h2-6,8-9H,1,7H2,(H,20,23)