[3-(2-bromanylphenoxy)-2-methyl-4-oxidanylidene-chromen-7-yl] 3-nitrobenzoate

Systemtic Name: [3-(2-bromanylphenoxy)-2-methyl-4-oxidanylidene-chromen-7-yl] 3-nitrobenzoate Openeye Name: [3-(2-bromophenoxy)-2-methyl-4-oxo-chromen-7-yl] 3-nitrobenzoate CAS Name: 3-nitrobenzoic acid [3-(2-bromophenoxy)-2-methyl-4-oxo-1-benzopyran-7-yl] ester IUPAC Name: [3-(2-bromophenoxy)-2-methyl-4-oxochromen-7-yl] 3-nitrobenzoate Traditional Name: 3-nitrobenzoic acid [3-(2-bromophenoxy)-4-keto-2-methyl-chromen-7-yl] ester Formula: C23H14BrNO7 MolecularWeight: 496.26376

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C2=C(O1)C=C(C=C2)OC(=O)C3=CC(=CC=C3)[N+](=O)[O-])OC4=CC=CC=C4Br

Isomeric SMILES

CC1=C(C(=O)C2=C(O1)C=C(C=C2)OC(=O)C3=CC(=CC=C3)[N+](=O)[O-])OC4=CC=CC=C4Br

InChI

InChI=1S/C23H14BrNO7/c1-13-22(32-19-8-3-2-7-18(19)24)21(26)17-10-9-16(12-20(17)30-13)31-23(27)14-5-4-6-15(11-14)25(28)29/h2-12H,1H3