[2-(3,4-dimethoxyphenyl)-5,7-dimethyl-4-oxidanylidene-chromen-3-yl] 4-chloranyl-3-nitro-benzoate

Systemtic Name: [2-(3,4-dimethoxyphenyl)-5,7-dimethyl-4-oxidanylidene-chromen-3-yl] 4-chloranyl-3-nitro-benzoate Openeye Name: [2-(3,4-dimethoxyphenyl)-5,7-dimethyl-4-oxo-chromen-3-yl] 4-chloro-3-nitro-benzoate CAS Name: 4-chloro-3-nitrobenzoic acid [2-(3,4-dimethoxyphenyl)-5,7-dimethyl-4-oxo-1-benzopyran-3-yl] ester IUPAC Name: [2-(3,4-dimethoxyphenyl)-5,7-dimethyl-4-oxochromen-3-yl] 4-chloro-3-nitrobenzoate Traditional Name: 4-chloro-3-nitro-benzoic acid [2-(3,4-dimethoxyphenyl)-4-keto-5,7-dimethyl-chromen-3-yl] ester Formula: C26H20ClNO8 MolecularWeight: 509.8919

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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)Cl)[N+](=O)[O-])C4=CC(=C(C=C4)OC)OC)C

Isomeric SMILES

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

InChI

InChI=1S/C26H20ClNO8/c1-13-9-14(2)22-21(10-13)35-24(15-6-8-19(33-3)20(12-15)34-4)25(23(22)29)36-26(30)16-5-7-17(27)18(11-16)28(31)32/h5-12H,1-4H3