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

Systemtic Name: (7-methoxy-2-oxidanylidene-chromen-4-yl)methyl 3-methyl-4-nitro-benzoate Openeye Name: (7-methoxy-2-oxo-chromen-4-yl)methyl 3-methyl-4-nitro-benzoate CAS Name: 3-methyl-4-nitrobenzoic acid (7-methoxy-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-methoxy-2-oxochromen-4-yl)methyl 3-methyl-4-nitrobenzoate Traditional Name: 3-methyl-4-nitro-benzoic acid (2-keto-7-methoxy-chromen-4-yl)methyl ester Formula: C19H15NO7 MolecularWeight: 369.3249

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)OCC2=CC(=O)OC3=C2C=CC(=C3)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)OCC2=CC(=O)OC3=C2C=CC(=C3)OC)[N+](=O)[O-]

InChI

InChI=1S/C19H15NO7/c1-11-7-12(3-6-16(11)20(23)24)19(22)26-10-13-8-18(21)27-17-9-14(25-2)4-5-15(13)17/h3-9H,10H2,1-2H3