diethyl 2-cyano-2-[(4-fluorophenyl)methyl]butanedioate

Systemtic Name: diethyl 2-cyano-2-[(4-fluorophenyl)methyl]butanedioate Openeye Name: diethyl 2-cyano-2-[(4-fluorophenyl)methyl]butanedioate CAS Name: 2-cyano-2-[(4-fluorophenyl)methyl]butanedioic acid diethyl ester IUPAC Name: diethyl 2-cyano-2-[(4-fluorophenyl)methyl]butanedioate Traditional Name: 2-cyano-2-(4-fluorobenzyl)succinic acid diethyl ester Formula: C16H18FNO4 MolecularWeight: 307.316823

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(CC1=CC=C(C=C1)F)(C#N)C(=O)OCC

Isomeric SMILES

CCOC(=O)CC(CC1=CC=C(C=C1)F)(C#N)C(=O)OCC

InChI

InChI=1S/C16H18FNO4/c1-3-21-14(19)10-16(11-18,15(20)22-4-2)9-12-5-7-13(17)8-6-12/h5-8H,3-4,9-10H2,1-2H3