(6-ethyl-4-methyl-2-oxidanylidene-chromen-7-yl) 3-methyl-4-nitro-benzoate

Systemtic Name: (6-ethyl-4-methyl-2-oxidanylidene-chromen-7-yl) 3-methyl-4-nitro-benzoate Openeye Name: (6-ethyl-4-methyl-2-oxo-chromen-7-yl) 3-methyl-4-nitro-benzoate CAS Name: 3-methyl-4-nitrobenzoic acid (6-ethyl-4-methyl-2-oxo-1-benzopyran-7-yl) ester IUPAC Name: (6-ethyl-4-methyl-2-oxochromen-7-yl) 3-methyl-4-nitrobenzoate Traditional Name: 3-methyl-4-nitro-benzoic acid (6-ethyl-2-keto-4-methyl-chromen-7-yl) ester Formula: C20H17NO6 MolecularWeight: 367.35208

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C2C(=C1)C(=CC(=O)O2)C)OC(=O)C3=CC(=C(C=C3)[N+](=O)[O-])C

Isomeric SMILES

CCC1=C(C=C2C(=C1)C(=CC(=O)O2)C)OC(=O)C3=CC(=C(C=C3)[N+](=O)[O-])C

InChI

InChI=1S/C20H17NO6/c1-4-13-9-15-11(2)8-19(22)26-18(15)10-17(13)27-20(23)14-5-6-16(21(24)25)12(3)7-14/h5-10H,4H2,1-3H3