N-[2-(1,3-benzodioxol-5-yl)ethyl]-2-chloranyl-5-nitro-benzamide

Systemtic Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-2-chloranyl-5-nitro-benzamide Openeye Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-2-chloro-5-nitro-benzamide CAS Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-2-chloro-5-nitrobenzamide IUPAC Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-2-chloro-5-nitrobenzamide Traditional Name: 2-chloro-N-homopiperonyl-5-nitro-benzamide Formula: C16H13ClN2O5 MolecularWeight: 348.73782

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CCNC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])Cl

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CCNC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C16H13ClN2O5/c17-13-3-2-11(19(21)22)8-12(13)16(20)18-6-5-10-1-4-14-15(7-10)24-9-23-14/h1-4,7-8H,5-6,9H2,(H,18,20)