N-[2-(1,3-benzodioxol-5-ylamino)-2-oxidanylidene-ethyl]-4-chloranyl-3-nitro-benzamide

Systemtic Name: N-[2-(1,3-benzodioxol-5-ylamino)-2-oxidanylidene-ethyl]-4-chloranyl-3-nitro-benzamide Openeye Name: N-[2-(1,3-benzodioxol-5-ylamino)-2-oxo-ethyl]-4-chloro-3-nitro-benzamide CAS Name: N-[2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl]-4-chloro-3-nitrobenzamide IUPAC Name: N-[2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl]-4-chloro-3-nitrobenzamide Traditional Name: N-[2-(1,3-benzodioxol-5-ylamino)-2-keto-ethyl]-4-chloro-3-nitro-benzamide Formula: C16H12ClN3O6 MolecularWeight: 377.73598

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H12ClN3O6/c17-11-3-1-9(5-12(11)20(23)24)16(22)18-7-15(21)19-10-2-4-13-14(6-10)26-8-25-13/h1-6H,7-8H2,(H,18,22)(H,19,21)