diethyl 2-[2-[2-methyl-4-(4-nitrophenyl)phenyl]-2-oxidanylidene-ethyl]-2-phenethyl-propanedioate

Systemtic Name: diethyl 2-[2-[2-methyl-4-(4-nitrophenyl)phenyl]-2-oxidanylidene-ethyl]-2-phenethyl-propanedioate Openeye Name: diethyl 2-[2-[2-methyl-4-(4-nitrophenyl)phenyl]-2-oxo-ethyl]-2-phenethyl-propanedioate CAS Name: 2-[2-[2-methyl-4-(4-nitrophenyl)phenyl]-2-oxoethyl]-2-phenethylpropanedioic acid diethyl ester IUPAC Name: diethyl 2-[2-[2-methyl-4-(4-nitrophenyl)phenyl]-2-oxoethyl]-2-phenethylpropanedioate Traditional Name: 2-[2-keto-2-[2-methyl-4-(4-nitrophenyl)phenyl]ethyl]-2-phenethyl-malonic acid diethyl ester Formula: C30H31NO7 MolecularWeight: 517.56964

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCC1=CC=CC=C1)(CC(=O)C2=C(C=C(C=C2)C3=CC=C(C=C3)[N+](=O)[O-])C)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(CCC1=CC=CC=C1)(CC(=O)C2=C(C=C(C=C2)C3=CC=C(C=C3)[N+](=O)[O-])C)C(=O)OCC

InChI

InChI=1S/C30H31NO7/c1-4-37-28(33)30(29(34)38-5-2,18-17-22-9-7-6-8-10-22)20-27(32)26-16-13-24(19-21(26)3)23-11-14-25(15-12-23)31(35)36/h6-16,19H,4-5,17-18,20H2,1-3H3