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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)C3=C(C(=CC=C3)C)[N+](=O)[O-]

Isomeric SMILES

CCC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)C3=C(C(=CC=C3)C)[N+](=O)[O-]

InChI

InChI=1S/C20H17NO6/c1-3-13-7-8-15-14(10-18(22)27-17(15)9-13)11-26-20(23)16-6-4-5-12(2)19(16)21(24)25/h4-10H,3,11H2,1-2H3