[2-(4-tert-butylphenyl)-7-methyl-4-oxidanylidene-chromen-3-yl] 2-(4-nitrophenoxy)ethanoate

Systemtic Name: [2-(4-tert-butylphenyl)-7-methyl-4-oxidanylidene-chromen-3-yl] 2-(4-nitrophenoxy)ethanoate Openeye Name: [2-(4-tert-butylphenyl)-7-methyl-4-oxo-chromen-3-yl] 2-(4-nitrophenoxy)acetate CAS Name: 2-(4-nitrophenoxy)acetic acid [2-(4-tert-butylphenyl)-7-methyl-4-oxo-1-benzopyran-3-yl] ester IUPAC Name: [2-(4-tert-butylphenyl)-7-methyl-4-oxochromen-3-yl] 2-(4-nitrophenoxy)acetate Traditional Name: 2-(4-nitrophenoxy)acetic acid [2-(4-tert-butylphenyl)-4-keto-7-methyl-chromen-3-yl] ester Formula: C28H25NO7 MolecularWeight: 487.5006

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=O)C(=C(O2)C3=CC=C(C=C3)C(C)(C)C)OC(=O)COC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=CC2=C(C=C1)C(=O)C(=C(O2)C3=CC=C(C=C3)C(C)(C)C)OC(=O)COC4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C28H25NO7/c1-17-5-14-22-23(15-17)35-26(18-6-8-19(9-7-18)28(2,3)4)27(25(22)31)36-24(30)16-34-21-12-10-20(11-13-21)29(32)33/h5-15H,16H2,1-4H3