[2-(4-chlorophenyl)-6-ethyl-4-oxidanylidene-chromen-3-yl] 3-nitrobenzoate

Systemtic Name: [2-(4-chlorophenyl)-6-ethyl-4-oxidanylidene-chromen-3-yl] 3-nitrobenzoate Openeye Name: [2-(4-chlorophenyl)-6-ethyl-4-oxo-chromen-3-yl] 3-nitrobenzoate CAS Name: 3-nitrobenzoic acid [2-(4-chlorophenyl)-6-ethyl-4-oxo-1-benzopyran-3-yl] ester IUPAC Name: [2-(4-chlorophenyl)-6-ethyl-4-oxochromen-3-yl] 3-nitrobenzoate Traditional Name: 3-nitrobenzoic acid [2-(4-chlorophenyl)-6-ethyl-4-keto-chromen-3-yl] ester Formula: C24H16ClNO6 MolecularWeight: 449.83994

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)OC(=C(C2=O)OC(=O)C3=CC(=CC=C3)[N+](=O)[O-])C4=CC=C(C=C4)Cl

Isomeric SMILES

CCC1=CC2=C(C=C1)OC(=C(C2=O)OC(=O)C3=CC(=CC=C3)[N+](=O)[O-])C4=CC=C(C=C4)Cl

InChI

InChI=1S/C24H16ClNO6/c1-2-14-6-11-20-19(12-14)21(27)23(22(31-20)15-7-9-17(25)10-8-15)32-24(28)16-4-3-5-18(13-16)26(29)30/h3-13H,2H2,1H3