N-cyclohexyl-2-[(E)-2-nitroprop-1-enyl]-5-oxidanyl-benzenecarbothioamide

Systemtic Name: N-cyclohexyl-2-[(E)-2-nitroprop-1-enyl]-5-oxidanyl-benzenecarbothioamide Openeye Name: N-cyclohexyl-5-hydroxy-2-[(E)-2-nitroprop-1-enyl]benzenecarbothioamide CAS Name: N-cyclohexyl-5-hydroxy-2-[(E)-2-nitroprop-1-enyl]benzenecarbothioamide IUPAC Name: N-cyclohexyl-5-hydroxy-2-[(E)-2-nitroprop-1-enyl]benzenecarbothioamide Traditional Name: N-cyclohexyl-5-hydroxy-2-[(E)-2-nitroprop-1-enyl]thiobenzamide Formula: C16H20N2O3S MolecularWeight: 320.4066

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC1=C(C=C(C=C1)O)C(=S)NC2CCCCC2)[N+](=O)[O-]

Isomeric SMILES

C/C(=C\C1=C(C=C(C=C1)O)C(=S)NC2CCCCC2)/[N+](=O)[O-]

InChI

InChI=1S/C16H20N2O3S/c1-11(18(20)21)9-12-7-8-14(19)10-15(12)16(22)17-13-5-3-2-4-6-13/h7-10,13,19H,2-6H2,1H3,(H,17,22)/b11-9+