(7-bromanyl-2-oxidanylidene-chromen-4-yl)methyl 2-methyl-6-nitro-benzoate

Systemtic Name: (7-bromanyl-2-oxidanylidene-chromen-4-yl)methyl 2-methyl-6-nitro-benzoate Openeye Name: (7-bromo-2-oxo-chromen-4-yl)methyl 2-methyl-6-nitro-benzoate CAS Name: 2-methyl-6-nitrobenzoic acid (7-bromo-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-bromo-2-oxochromen-4-yl)methyl 2-methyl-6-nitrobenzoate Traditional Name: 2-methyl-6-nitro-benzoic acid (7-bromo-2-keto-chromen-4-yl)methyl ester Formula: C18H12BrNO6 MolecularWeight: 418.19498

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H12BrNO6/c1-10-3-2-4-14(20(23)24)17(10)18(22)25-9-11-7-16(21)26-15-8-12(19)5-6-13(11)15/h2-8H,9H2,1H3