2-(3,4-dimethoxyphenyl)-2-[2-(4-nitrophenyl)ethyl]-3-oxidanylidene-butanal

Systemtic Name: 2-(3,4-dimethoxyphenyl)-2-[2-(4-nitrophenyl)ethyl]-3-oxidanylidene-butanal Openeye Name: 2-(3,4-dimethoxyphenyl)-2-[2-(4-nitrophenyl)ethyl]-3-oxo-butanal CAS Name: 2-(3,4-dimethoxyphenyl)-2-[2-(4-nitrophenyl)ethyl]-3-oxobutanal IUPAC Name: 2-(3,4-dimethoxyphenyl)-2-[2-(4-nitrophenyl)ethyl]-3-oxobutanal Traditional Name: 2-(3,4-dimethoxyphenyl)-3-keto-2-[2-(4-nitrophenyl)ethyl]butyraldehyde Formula: C20H21NO6 MolecularWeight: 371.38384

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(CCC1=CC=C(C=C1)[N+](=O)[O-])(C=O)C2=CC(=C(C=C2)OC)OC

Isomeric SMILES

CC(=O)C(CCC1=CC=C(C=C1)[N+](=O)[O-])(C=O)C2=CC(=C(C=C2)OC)OC

InChI

InChI=1S/C20H21NO6/c1-14(23)20(13-22,16-6-9-18(26-2)19(12-16)27-3)11-10-15-4-7-17(8-5-15)21(24)25/h4-9,12-13H,10-11H2,1-3H3