(phenylmethyl) 3-[4-(hexadecan-2-ylamino)phenyl]propanoate

Systemtic Name: (phenylmethyl) 3-[4-(hexadecan-2-ylamino)phenyl]propanoate Openeye Name: benzyl 3-[4-(1-methylpentadecylamino)phenyl]propanoate CAS Name: 3-[4-(hexadecan-2-ylamino)phenyl]propanoic acid (phenylmethyl) ester IUPAC Name: benzyl 3-[4-(hexadecan-2-ylamino)phenyl]propanoate Traditional Name: 3-[4-(1-methylpentadecylamino)phenyl]propionic acid benzyl ester Formula: C32H49NO2 MolecularWeight: 479.73696

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCC(C)NC1=CC=C(C=C1)CCC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CCCCCCCCCCCCCCC(C)NC1=CC=C(C=C1)CCC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C32H49NO2/c1-3-4-5-6-7-8-9-10-11-12-13-15-18-28(2)33-31-24-21-29(22-25-31)23-26-32(34)35-27-30-19-16-14-17-20-30/h14,16-17,19-22,24-25,28,33H,3-13,15,18,23,26-27H2,1-2H3