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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)OC2=C1C=CC(=C2)OC(=O)C3=CC(=C(C=C3)[N+](=O)[O-])C

Isomeric SMILES

CCCC1=CC(=O)OC2=C1C=CC(=C2)OC(=O)C3=CC(=C(C=C3)[N+](=O)[O-])C

InChI

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