(4-propanoylphenyl) 8-methoxy-6-nitro-2-oxidanylidene-chromene-3-carboxylate

Systemtic Name: (4-propanoylphenyl) 8-methoxy-6-nitro-2-oxidanylidene-chromene-3-carboxylate Openeye Name: (4-propanoylphenyl) 8-methoxy-6-nitro-2-oxo-chromene-3-carboxylate CAS Name: 8-methoxy-6-nitro-2-oxo-1-benzopyran-3-carboxylic acid [4-(1-oxopropyl)phenyl] ester IUPAC Name: (4-propanoylphenyl) 8-methoxy-6-nitro-2-oxochromene-3-carboxylate Traditional Name: 2-keto-8-methoxy-6-nitro-chromene-3-carboxylic acid (4-propionylphenyl) ester Formula: C20H15NO8 MolecularWeight: 397.335

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=CC=C(C=C1)OC(=O)C2=CC3=CC(=CC(=C3OC2=O)OC)[N+](=O)[O-]

Isomeric SMILES

CCC(=O)C1=CC=C(C=C1)OC(=O)C2=CC3=CC(=CC(=C3OC2=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C20H15NO8/c1-3-16(22)11-4-6-14(7-5-11)28-19(23)15-9-12-8-13(21(25)26)10-17(27-2)18(12)29-20(15)24/h4-10H,3H2,1-2H3