diethyl 2-azanyl-2-[2-(4-octylphenyl)ethyl]propanedioate

Systemtic Name: diethyl 2-azanyl-2-[2-(4-octylphenyl)ethyl]propanedioate Openeye Name: diethyl 2-amino-2-[2-(4-octylphenyl)ethyl]propanedioate CAS Name: 2-amino-2-[2-(4-octylphenyl)ethyl]propanedioic acid diethyl ester IUPAC Name: diethyl 2-amino-2-[2-(4-octylphenyl)ethyl]propanedioate Traditional Name: 2-amino-2-[2-(4-octylphenyl)ethyl]malonic acid diethyl ester Formula: C23H37NO4 MolecularWeight: 391.54418

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=C(C=C1)CCC(C(=O)OCC)(C(=O)OCC)N

Isomeric SMILES

CCCCCCCCC1=CC=C(C=C1)CCC(C(=O)OCC)(C(=O)OCC)N

InChI

InChI=1S/C23H37NO4/c1-4-7-8-9-10-11-12-19-13-15-20(16-14-19)17-18-23(24,21(25)27-5-2)22(26)28-6-3/h13-16H,4-12,17-18,24H2,1-3H3