N-[7-(4-chlorophenyl)carbonyl-2,3-dihydro-1,4-benzodioxin-6-yl]-3-nitro-benzamide

Systemtic Name: N-[7-(4-chlorophenyl)carbonyl-2,3-dihydro-1,4-benzodioxin-6-yl]-3-nitro-benzamide Openeye Name: N-[7-(4-chlorobenzoyl)-2,3-dihydro-1,4-benzodioxin-6-yl]-3-nitro-benzamide CAS Name: N-[7-[(4-chlorophenyl)-oxomethyl]-2,3-dihydro-1,4-benzodioxin-6-yl]-3-nitrobenzamide IUPAC Name: N-[7-(4-chlorobenzoyl)-2,3-dihydro-1,4-benzodioxin-6-yl]-3-nitrobenzamide Traditional Name: N-[7-(4-chlorobenzoyl)-2,3-dihydro-1,4-benzodioxin-6-yl]-3-nitro-benzamide Formula: C22H15ClN2O6 MolecularWeight: 438.8173

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=C(C(=C2)NC(=O)C3=CC(=CC=C3)[N+](=O)[O-])C(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1COC2=C(O1)C=C(C(=C2)NC(=O)C3=CC(=CC=C3)[N+](=O)[O-])C(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C22H15ClN2O6/c23-15-6-4-13(5-7-15)21(26)17-11-19-20(31-9-8-30-19)12-18(17)24-22(27)14-2-1-3-16(10-14)25(28)29/h1-7,10-12H,8-9H2,(H,24,27)