pentyl 2-(4-methyl-6-nitro-2-oxidanylidene-chromen-7-yl)oxypropanoate

Systemtic Name: pentyl 2-(4-methyl-6-nitro-2-oxidanylidene-chromen-7-yl)oxypropanoate Openeye Name: pentyl 2-(4-methyl-6-nitro-2-oxo-chromen-7-yl)oxypropanoate CAS Name: 2-[(4-methyl-6-nitro-2-oxo-1-benzopyran-7-yl)oxy]propanoic acid pentyl ester IUPAC Name: pentyl 2-(4-methyl-6-nitro-2-oxochromen-7-yl)oxypropanoate Traditional Name: 2-(2-keto-4-methyl-6-nitro-chromen-7-yl)oxypropionic acid amyl ester Formula: C18H21NO7 MolecularWeight: 363.36184

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC(=O)C(C)OC1=C(C=C2C(=CC(=O)OC2=C1)C)[N+](=O)[O-]

Isomeric SMILES

CCCCCOC(=O)C(C)OC1=C(C=C2C(=CC(=O)OC2=C1)C)[N+](=O)[O-]

InChI

InChI=1S/C18H21NO7/c1-4-5-6-7-24-18(21)12(3)25-16-10-15-13(9-14(16)19(22)23)11(2)8-17(20)26-15/h8-10,12H,4-7H2,1-3H3