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

Systemtic Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-3-nitro-benzamide Openeye Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-3-nitro-benzamide CAS Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-3-nitrobenzamide IUPAC Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-3-nitrobenzamide Traditional Name: N-homopiperonyl-3-nitro-benzamide Formula: C16H14N2O5 MolecularWeight: 314.29276

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H14N2O5/c19-16(12-2-1-3-13(9-12)18(20)21)17-7-6-11-4-5-14-15(8-11)23-10-22-14/h1-5,8-9H,6-7,10H2,(H,17,19)