(phenylmethyl) 3-[4-(nonadecylamino)phenyl]propanoate

Systemtic Name: (phenylmethyl) 3-[4-(nonadecylamino)phenyl]propanoate Openeye Name: benzyl 3-[4-(nonadecylamino)phenyl]propanoate CAS Name: 3-[4-(nonadecylamino)phenyl]propanoic acid (phenylmethyl) ester IUPAC Name: benzyl 3-[4-(nonadecylamino)phenyl]propanoate Traditional Name: 3-[4-(nonadecylamino)phenyl]propionic acid benzyl ester Formula: C35H55NO2 MolecularWeight: 521.8167

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCNC1=CC=C(C=C1)CCC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCNC1=CC=C(C=C1)CCC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C35H55NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21-30-36-34-27-24-32(25-28-34)26-29-35(37)38-31-33-22-19-18-20-23-33/h18-20,22-25,27-28,36H,2-17,21,26,29-31H2,1H3