(7,8-dimethyl-2-oxidanylidene-chromen-4-yl)methyl 2-nitrobenzoate

Systemtic Name: (7,8-dimethyl-2-oxidanylidene-chromen-4-yl)methyl 2-nitrobenzoate Openeye Name: (7,8-dimethyl-2-oxo-chromen-4-yl)methyl 2-nitrobenzoate CAS Name: 2-nitrobenzoic acid (7,8-dimethyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7,8-dimethyl-2-oxochromen-4-yl)methyl 2-nitrobenzoate Traditional Name: 2-nitrobenzoic acid (2-keto-7,8-dimethyl-chromen-4-yl)methyl ester Formula: C19H15NO6 MolecularWeight: 353.3255

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)C(=CC(=O)O2)COC(=O)C3=CC=CC=C3[N+](=O)[O-])C

Isomeric SMILES

CC1=C(C2=C(C=C1)C(=CC(=O)O2)COC(=O)C3=CC=CC=C3[N+](=O)[O-])C

InChI

InChI=1S/C19H15NO6/c1-11-7-8-14-13(9-17(21)26-18(14)12(11)2)10-25-19(22)15-5-3-4-6-16(15)20(23)24/h3-9H,10H2,1-2H3