diethyl 4-cyano-4-(2-naphthalen-1-ylphenyl)heptanedioate

Systemtic Name: diethyl 4-cyano-4-(2-naphthalen-1-ylphenyl)heptanedioate Openeye Name: diethyl 4-cyano-4-[2-(1-naphthyl)phenyl]heptanedioate CAS Name: 4-cyano-4-[2-(1-naphthalenyl)phenyl]heptanedioic acid diethyl ester IUPAC Name: diethyl 4-cyano-4-(2-naphthalen-1-ylphenyl)heptanedioate Traditional Name: 4-cyano-4-[2-(1-naphthyl)phenyl]pimelic acid diethyl ester Formula: C28H29NO4 MolecularWeight: 443.53416

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC(CCC(=O)OCC)(C#N)C1=CC=CC=C1C2=CC=CC3=CC=CC=C32

Isomeric SMILES

CCOC(=O)CCC(CCC(=O)OCC)(C#N)C1=CC=CC=C1C2=CC=CC3=CC=CC=C32

InChI

InChI=1S/C28H29NO4/c1-3-32-26(30)16-18-28(20-29,19-17-27(31)33-4-2)25-15-8-7-13-24(25)23-14-9-11-21-10-5-6-12-22(21)23/h5-15H,3-4,16-19H2,1-2H3