[4-oxidanylidene-3-(2-propan-2-ylphenoxy)chromen-7-yl] 2-methyl-3-nitro-benzoate

Systemtic Name: [4-oxidanylidene-3-(2-propan-2-ylphenoxy)chromen-7-yl] 2-methyl-3-nitro-benzoate Openeye Name: [3-(2-isopropylphenoxy)-4-oxo-chromen-7-yl] 2-methyl-3-nitro-benzoate CAS Name: 2-methyl-3-nitrobenzoic acid [4-oxo-3-(2-propan-2-ylphenoxy)-1-benzopyran-7-yl] ester IUPAC Name: [4-oxo-3-(2-propan-2-ylphenoxy)chromen-7-yl] 2-methyl-3-nitrobenzoate Traditional Name: 2-methyl-3-nitro-benzoic acid [3-(2-isopropylphenoxy)-4-keto-chromen-7-yl] ester Formula: C26H21NO7 MolecularWeight: 459.44744

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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)OC4=CC=CC=C4C(C)C

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])C(=O)OC2=CC3=C(C=C2)C(=O)C(=CO3)OC4=CC=CC=C4C(C)C

InChI

InChI=1S/C26H21NO7/c1-15(2)18-7-4-5-10-22(18)34-24-14-32-23-13-17(11-12-20(23)25(24)28)33-26(29)19-8-6-9-21(16(19)3)27(30)31/h4-15H,1-3H3