ethyl 3-[4-methyl-7-[(4-nitrophenyl)methoxy]-2-oxidanylidene-chromen-3-yl]propanoate

Systemtic Name: ethyl 3-[4-methyl-7-[(4-nitrophenyl)methoxy]-2-oxidanylidene-chromen-3-yl]propanoate Openeye Name: ethyl 3-[4-methyl-7-[(4-nitrophenyl)methoxy]-2-oxo-chromen-3-yl]propanoate CAS Name: 3-[4-methyl-7-[(4-nitrophenyl)methoxy]-2-oxo-1-benzopyran-3-yl]propanoic acid ethyl ester IUPAC Name: ethyl 3-[4-methyl-7-[(4-nitrophenyl)methoxy]-2-oxochromen-3-yl]propanoate Traditional Name: 3-[2-keto-4-methyl-7-(4-nitrobenzyl)oxy-chromen-3-yl]propionic acid ethyl ester Formula: C22H21NO7 MolecularWeight: 411.40464

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC1=C(C2=C(C=C(C=C2)OCC3=CC=C(C=C3)[N+](=O)[O-])OC1=O)C

Isomeric SMILES

CCOC(=O)CCC1=C(C2=C(C=C(C=C2)OCC3=CC=C(C=C3)[N+](=O)[O-])OC1=O)C

InChI

InChI=1S/C22H21NO7/c1-3-28-21(24)11-10-19-14(2)18-9-8-17(12-20(18)30-22(19)25)29-13-15-4-6-16(7-5-15)23(26)27/h4-9,12H,3,10-11,13H2,1-2H3