N-[(S)-cyano-(4-fluorophenyl)methyl]-3-nitro-benzamide

Systemtic Name: N-[(S)-cyano-(4-fluorophenyl)methyl]-3-nitro-benzamide Openeye Name: N-[(S)-cyano-(4-fluorophenyl)methyl]-3-nitro-benzamide CAS Name: N-[(S)-cyano-(4-fluorophenyl)methyl]-3-nitrobenzamide IUPAC Name: N-[(S)-cyano-(4-fluorophenyl)methyl]-3-nitrobenzamide Traditional Name: N-[(S)-cyano-(4-fluorophenyl)methyl]-3-nitro-benzamide Formula: C15H10FN3O3 MolecularWeight: 299.256603

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)NC(C#N)C2=CC=C(C=C2)F

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)N[C@H](C#N)C2=CC=C(C=C2)F

InChI

InChI=1S/C15H10FN3O3/c16-12-6-4-10(5-7-12)14(9-17)18-15(20)11-2-1-3-13(8-11)19(21)22/h1-8,14H,(H,18,20)/t14-/m1/s1