[3-(3,4-dimethoxyphenyl)-4-methyl-2-oxidanylidene-chromen-6-yl] 3-nitrobenzoate

Systemtic Name: [3-(3,4-dimethoxyphenyl)-4-methyl-2-oxidanylidene-chromen-6-yl] 3-nitrobenzoate Openeye Name: [3-(3,4-dimethoxyphenyl)-4-methyl-2-oxo-chromen-6-yl] 3-nitrobenzoate CAS Name: 3-nitrobenzoic acid [3-(3,4-dimethoxyphenyl)-4-methyl-2-oxo-1-benzopyran-6-yl] ester IUPAC Name: [3-(3,4-dimethoxyphenyl)-4-methyl-2-oxochromen-6-yl] 3-nitrobenzoate Traditional Name: 3-nitrobenzoic acid [3-(3,4-dimethoxyphenyl)-2-keto-4-methyl-chromen-6-yl] ester Formula: C25H19NO8 MolecularWeight: 461.42026

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C1C=C(C=C2)OC(=O)C3=CC(=CC=C3)[N+](=O)[O-])C4=CC(=C(C=C4)OC)OC

Isomeric SMILES

CC1=C(C(=O)OC2=C1C=C(C=C2)OC(=O)C3=CC(=CC=C3)[N+](=O)[O-])C4=CC(=C(C=C4)OC)OC

InChI

InChI=1S/C25H19NO8/c1-14-19-13-18(33-24(27)16-5-4-6-17(11-16)26(29)30)8-10-20(19)34-25(28)23(14)15-7-9-21(31-2)22(12-15)32-3/h4-13H,1-3H3