[3-(2-methoxyethylcarbamoyl)-2-oxidanylidene-chromen-7-yl] 3-nitrobenzoate

Systemtic Name: [3-(2-methoxyethylcarbamoyl)-2-oxidanylidene-chromen-7-yl] 3-nitrobenzoate Openeye Name: [3-(2-methoxyethylcarbamoyl)-2-oxo-chromen-7-yl] 3-nitrobenzoate CAS Name: 3-nitrobenzoic acid [3-[(2-methoxyethylamino)-oxomethyl]-2-oxo-1-benzopyran-7-yl] ester IUPAC Name: [3-(2-methoxyethylcarbamoyl)-2-oxochromen-7-yl] 3-nitrobenzoate Traditional Name: 3-nitrobenzoic acid [2-keto-3-(2-methoxyethylcarbamoyl)chromen-7-yl] ester Formula: C20H16N2O8 MolecularWeight: 412.34964

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COCCNC(=O)C1=CC2=C(C=C(C=C2)OC(=O)C3=CC(=CC=C3)[N+](=O)[O-])OC1=O

Isomeric SMILES

COCCNC(=O)C1=CC2=C(C=C(C=C2)OC(=O)C3=CC(=CC=C3)[N+](=O)[O-])OC1=O

InChI

InChI=1S/C20H16N2O8/c1-28-8-7-21-18(23)16-10-12-5-6-15(11-17(12)30-20(16)25)29-19(24)13-3-2-4-14(9-13)22(26)27/h2-6,9-11H,7-8H2,1H3,(H,21,23)