ethyl 3-(3,4-dimethoxyphenyl)-7-(3-nitrophenyl)carbonyloxy-4-oxidanylidene-chromene-2-carboxylate

Systemtic Name: ethyl 3-(3,4-dimethoxyphenyl)-7-(3-nitrophenyl)carbonyloxy-4-oxidanylidene-chromene-2-carboxylate Openeye Name: ethyl 3-(3,4-dimethoxyphenyl)-7-(3-nitrobenzoyl)oxy-4-oxo-chromene-2-carboxylate CAS Name: 3-(3,4-dimethoxyphenyl)-7-[(3-nitrophenyl)-oxomethoxy]-4-oxo-1-benzopyran-2-carboxylic acid ethyl ester IUPAC Name: ethyl 3-(3,4-dimethoxyphenyl)-7-(3-nitrobenzoyl)oxy-4-oxochromene-2-carboxylate Traditional Name: 3-(3,4-dimethoxyphenyl)-4-keto-7-(3-nitrobenzoyl)oxy-chromene-2-carboxylic acid ethyl ester Formula: C27H21NO10 MolecularWeight: 519.45634

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=O)C2=C(O1)C=C(C=C2)OC(=O)C3=CC(=CC=C3)[N+](=O)[O-])C4=CC(=C(C=C4)OC)OC

Isomeric SMILES

CCOC(=O)C1=C(C(=O)C2=C(O1)C=C(C=C2)OC(=O)C3=CC(=CC=C3)[N+](=O)[O-])C4=CC(=C(C=C4)OC)OC

InChI

InChI=1S/C27H21NO10/c1-4-36-27(31)25-23(15-8-11-20(34-2)22(13-15)35-3)24(29)19-10-9-18(14-21(19)38-25)37-26(30)16-6-5-7-17(12-16)28(32)33/h5-14H,4H2,1-3H3