ethyl 3-(3,4-dimethoxyphenyl)-7-[(4-nitrophenyl)methoxy]-4-oxidanylidene-chromene-2-carboxylate

Systemtic Name: ethyl 3-(3,4-dimethoxyphenyl)-7-[(4-nitrophenyl)methoxy]-4-oxidanylidene-chromene-2-carboxylate Openeye Name: ethyl 3-(3,4-dimethoxyphenyl)-7-[(4-nitrophenyl)methoxy]-4-oxo-chromene-2-carboxylate CAS Name: 3-(3,4-dimethoxyphenyl)-7-[(4-nitrophenyl)methoxy]-4-oxo-1-benzopyran-2-carboxylic acid ethyl ester IUPAC Name: ethyl 3-(3,4-dimethoxyphenyl)-7-[(4-nitrophenyl)methoxy]-4-oxochromene-2-carboxylate Traditional Name: 3-(3,4-dimethoxyphenyl)-4-keto-7-(4-nitrobenzyl)oxy-chromene-2-carboxylic acid ethyl ester Formula: C27H23NO9 MolecularWeight: 505.47282

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=O)C2=C(O1)C=C(C=C2)OCC3=CC=C(C=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)OCC3=CC=C(C=C3)[N+](=O)[O-])C4=CC(=C(C=C4)OC)OC

InChI

InChI=1S/C27H23NO9/c1-4-35-27(30)26-24(17-7-12-21(33-2)23(13-17)34-3)25(29)20-11-10-19(14-22(20)37-26)36-15-16-5-8-18(9-6-16)28(31)32/h5-14H,4,15H2,1-3H3