N-[2-(cyclohexen-1-yl)ethyl]-2-(4-nitrophenyl)sulfanyl-propanamide

Systemtic Name: N-[2-(cyclohexen-1-yl)ethyl]-2-(4-nitrophenyl)sulfanyl-propanamide Openeye Name: N-[2-(cyclohexen-1-yl)ethyl]-2-(4-nitrophenyl)sulfanyl-propanamide CAS Name: N-[2-(1-cyclohexenyl)ethyl]-2-[(4-nitrophenyl)thio]propanamide IUPAC Name: N-[2-(cyclohexen-1-yl)ethyl]-2-(4-nitrophenyl)sulfanylpropanamide Traditional Name: N-[2-(cyclohexen-1-yl)ethyl]-2-[(4-nitrophenyl)thio]propionamide Formula: C17H22N2O3S MolecularWeight: 334.43318

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCCC1=CCCCC1)SC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C(=O)NCCC1=CCCCC1)SC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C17H22N2O3S/c1-13(23-16-9-7-15(8-10-16)19(21)22)17(20)18-12-11-14-5-3-2-4-6-14/h5,7-10,13H,2-4,6,11-12H2,1H3,(H,18,20)