3-(4-chlorophenyl)-2-nitro-3,5,6,7-tetrahydro-2H-1-benzofuran-4-one

Systemtic Name: 3-(4-chlorophenyl)-2-nitro-3,5,6,7-tetrahydro-2H-1-benzofuran-4-one Openeye Name: 3-(4-chlorophenyl)-2-nitro-3,5,6,7-tetrahydro-2H-benzofuran-4-one CAS Name: 3-(4-chlorophenyl)-2-nitro-3,5,6,7-tetrahydro-2H-benzofuran-4-one IUPAC Name: 3-(4-chlorophenyl)-2-nitro-3,5,6,7-tetrahydro-2H-1-benzofuran-4-one Traditional Name: 3-(4-chlorophenyl)-2-nitro-3,5,6,7-tetrahydro-2H-benzofuran-4-one Formula: C14H12ClNO4 MolecularWeight: 293.70238

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C(C(O2)[N+](=O)[O-])C3=CC=C(C=C3)Cl)C(=O)C1

Isomeric SMILES

C1CC2=C(C(C(O2)[N+](=O)[O-])C3=CC=C(C=C3)Cl)C(=O)C1

InChI

InChI=1S/C14H12ClNO4/c15-9-6-4-8(5-7-9)12-13-10(17)2-1-3-11(13)20-14(12)16(18)19/h4-7,12,14H,1-3H2