N-[(1S,6S)-6-cyanocyclohex-3-en-1-yl]-4-nitro-benzamide

Systemtic Name: N-[(1S,6S)-6-cyanocyclohex-3-en-1-yl]-4-nitro-benzamide Openeye Name: N-[(1S,6S)-6-cyanocyclohex-3-en-1-yl]-4-nitro-benzamide CAS Name: N-[(1S,6S)-6-cyano-1-cyclohex-3-enyl]-4-nitrobenzamide IUPAC Name: N-[(1S,6S)-6-cyanocyclohex-3-en-1-yl]-4-nitrobenzamide Traditional Name: N-[(1S,6S)-6-cyanocyclohex-3-en-1-yl]-4-nitro-benzamide Formula: C14H13N3O3 MolecularWeight: 271.27132

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C=CCC(C1C#N)NC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C1C=CC[C@@H]([C@H]1C#N)NC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C14H13N3O3/c15-9-11-3-1-2-4-13(11)16-14(18)10-5-7-12(8-6-10)17(19)20/h1-2,5-8,11,13H,3-4H2,(H,16,18)/t11-,13+/m1/s1