[2-(4-methoxyphenyl)-5,7-dimethyl-4-oxidanylidene-chromen-3-yl] 4-nitrobenzoate

Systemtic Name: [2-(4-methoxyphenyl)-5,7-dimethyl-4-oxidanylidene-chromen-3-yl] 4-nitrobenzoate Openeye Name: [2-(4-methoxyphenyl)-5,7-dimethyl-4-oxo-chromen-3-yl] 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid [2-(4-methoxyphenyl)-5,7-dimethyl-4-oxo-1-benzopyran-3-yl] ester IUPAC Name: [2-(4-methoxyphenyl)-5,7-dimethyl-4-oxochromen-3-yl] 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid [4-keto-2-(4-methoxyphenyl)-5,7-dimethyl-chromen-3-yl] ester Formula: C25H19NO7 MolecularWeight: 445.42086

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)OC(=C(C2=O)OC(=O)C3=CC=C(C=C3)[N+](=O)[O-])C4=CC=C(C=C4)OC)C

Isomeric SMILES

CC1=CC(=C2C(=C1)OC(=C(C2=O)OC(=O)C3=CC=C(C=C3)[N+](=O)[O-])C4=CC=C(C=C4)OC)C

InChI

InChI=1S/C25H19NO7/c1-14-12-15(2)21-20(13-14)32-23(16-6-10-19(31-3)11-7-16)24(22(21)27)33-25(28)17-4-8-18(9-5-17)26(29)30/h4-13H,1-3H3