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

Systemtic Name: (4-oxidanylidene-3-phenyl-chromen-7-yl) 2-methyl-3-nitro-benzoate Openeye Name: (4-oxo-3-phenyl-chromen-7-yl) 2-methyl-3-nitro-benzoate CAS Name: 2-methyl-3-nitrobenzoic acid (4-oxo-3-phenyl-1-benzopyran-7-yl) ester IUPAC Name: (4-oxo-3-phenylchromen-7-yl) 2-methyl-3-nitrobenzoate Traditional Name: 2-methyl-3-nitro-benzoic acid (4-keto-3-phenyl-chromen-7-yl) ester Formula: C23H15NO6 MolecularWeight: 401.3683

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])C(=O)OC2=CC3=C(C=C2)C(=O)C(=CO3)C4=CC=CC=C4

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])C(=O)OC2=CC3=C(C=C2)C(=O)C(=CO3)C4=CC=CC=C4

InChI

InChI=1S/C23H15NO6/c1-14-17(8-5-9-20(14)24(27)28)23(26)30-16-10-11-18-21(12-16)29-13-19(22(18)25)15-6-3-2-4-7-15/h2-13H,1H3