N-[4-(3-chloranyl-2-oxidanyl-propoxy)-3-nitro-phenyl]propanamide

Systemtic Name: N-[4-(3-chloranyl-2-oxidanyl-propoxy)-3-nitro-phenyl]propanamide Openeye Name: N-[4-(3-chloro-2-hydroxy-propoxy)-3-nitro-phenyl]propanamide CAS Name: N-[4-(3-chloro-2-hydroxypropoxy)-3-nitrophenyl]propanamide IUPAC Name: N-[4-(3-chloro-2-hydroxypropoxy)-3-nitrophenyl]propanamide Traditional Name: N-[4-(3-chloro-2-hydroxy-propoxy)-3-nitro-phenyl]propionamide Formula: C12H15ClN2O5 MolecularWeight: 302.7109

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC(=C(C=C1)OCC(CCl)O)[N+](=O)[O-]

Isomeric SMILES

CCC(=O)NC1=CC(=C(C=C1)OCC(CCl)O)[N+](=O)[O-]

InChI

InChI=1S/C12H15ClN2O5/c1-2-12(17)14-8-3-4-11(10(5-8)15(18)19)20-7-9(16)6-13/h3-5,9,16H,2,6-7H2,1H3,(H,14,17)