4-nitro-N-[(Z)-(2-oxidanylidenecyclohexylidene)-sulfanyl-methyl]benzamide

Systemtic Name: 4-nitro-N-[(Z)-(2-oxidanylidenecyclohexylidene)-sulfanyl-methyl]benzamide Openeye Name: 4-nitro-N-[(Z)-(2-oxocyclohexylidene)-sulfanyl-methyl]benzamide CAS Name: N-[(Z)-mercapto-(2-oxocyclohexylidene)methyl]-4-nitrobenzamide IUPAC Name: 4-nitro-N-[(Z)-(2-oxocyclohexylidene)-sulfanylmethyl]benzamide Traditional Name: N-[(Z)-(2-ketocyclohexylidene)-mercapto-methyl]-4-nitro-benzamide Formula: C14H14N2O4S MolecularWeight: 306.33696

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=O)C(=C(NC(=O)C2=CC=C(C=C2)[N+](=O)[O-])S)C1

Isomeric SMILES

C1CCC(=O)/C(=C(/NC(=O)C2=CC=C(C=C2)[N+](=O)[O-])\S)/C1

InChI

InChI=1S/C14H14N2O4S/c17-12-4-2-1-3-11(12)14(21)15-13(18)9-5-7-10(8-6-9)16(19)20/h5-8,21H,1-4H2,(H,15,18)/b14-11-