diethyl 2-(2-nitro-1-phenyl-ethyl)-2-prop-2-enyl-propanedioate

Systemtic Name: diethyl 2-(2-nitro-1-phenyl-ethyl)-2-prop-2-enyl-propanedioate Openeye Name: diethyl 2-allyl-2-(2-nitro-1-phenyl-ethyl)propanedioate CAS Name: 2-(2-nitro-1-phenylethyl)-2-prop-2-enylpropanedioic acid diethyl ester IUPAC Name: diethyl 2-(2-nitro-1-phenylethyl)-2-prop-2-enylpropanedioate Traditional Name: 2-allyl-2-(2-nitro-1-phenyl-ethyl)malonic acid diethyl ester Formula: C18H23NO6 MolecularWeight: 349.37832

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H23NO6/c1-4-12-18(16(20)24-5-2,17(21)25-6-3)15(13-19(22)23)14-10-8-7-9-11-14/h4,7-11,15H,1,5-6,12-13H2,2-3H3