methyl 2-[5-[(2-methoxy-5-nitro-phenyl)methoxy]-4,7-dimethyl-2-oxidanylidene-chromen-3-yl]ethanoate

Systemtic Name: methyl 2-[5-[(2-methoxy-5-nitro-phenyl)methoxy]-4,7-dimethyl-2-oxidanylidene-chromen-3-yl]ethanoate Openeye Name: methyl 2-[5-[(2-methoxy-5-nitro-phenyl)methoxy]-4,7-dimethyl-2-oxo-chromen-3-yl]acetate CAS Name: 2-[5-[(2-methoxy-5-nitrophenyl)methoxy]-4,7-dimethyl-2-oxo-1-benzopyran-3-yl]acetic acid methyl ester IUPAC Name: methyl 2-[5-[(2-methoxy-5-nitrophenyl)methoxy]-4,7-dimethyl-2-oxochromen-3-yl]acetate Traditional Name: 2-[2-keto-5-(2-methoxy-5-nitro-benzyl)oxy-4,7-dimethyl-chromen-3-yl]acetic acid methyl ester Formula: C22H21NO8 MolecularWeight: 427.40404

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C(=C(C(=O)O2)CC(=O)OC)C)C(=C1)OCC3=C(C=CC(=C3)[N+](=O)[O-])OC

Isomeric SMILES

CC1=CC2=C(C(=C(C(=O)O2)CC(=O)OC)C)C(=C1)OCC3=C(C=CC(=C3)[N+](=O)[O-])OC

InChI

InChI=1S/C22H21NO8/c1-12-7-18(30-11-14-9-15(23(26)27)5-6-17(14)28-3)21-13(2)16(10-20(24)29-4)22(25)31-19(21)8-12/h5-9H,10-11H2,1-4H3