ethyl 3-[6-chloranyl-4-methyl-7-[(4-nitrophenyl)methoxy]-2-oxidanylidene-chromen-3-yl]propanoate

Systemtic Name: ethyl 3-[6-chloranyl-4-methyl-7-[(4-nitrophenyl)methoxy]-2-oxidanylidene-chromen-3-yl]propanoate Openeye Name: ethyl 3-[6-chloro-4-methyl-7-[(4-nitrophenyl)methoxy]-2-oxo-chromen-3-yl]propanoate CAS Name: 3-[6-chloro-4-methyl-7-[(4-nitrophenyl)methoxy]-2-oxo-1-benzopyran-3-yl]propanoic acid ethyl ester IUPAC Name: ethyl 3-[6-chloro-4-methyl-7-[(4-nitrophenyl)methoxy]-2-oxochromen-3-yl]propanoate Traditional Name: 3-[6-chloro-2-keto-4-methyl-7-(4-nitrobenzyl)oxy-chromen-3-yl]propionic acid ethyl ester Formula: C22H20ClNO7 MolecularWeight: 445.8497

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC1=C(C2=CC(=C(C=C2OC1=O)OCC3=CC=C(C=C3)[N+](=O)[O-])Cl)C

Isomeric SMILES

CCOC(=O)CCC1=C(C2=CC(=C(C=C2OC1=O)OCC3=CC=C(C=C3)[N+](=O)[O-])Cl)C

InChI

InChI=1S/C22H20ClNO7/c1-3-29-21(25)9-8-16-13(2)17-10-18(23)20(11-19(17)31-22(16)26)30-12-14-4-6-15(7-5-14)24(27)28/h4-7,10-11H,3,8-9,12H2,1-2H3