3-oxidanylpropyl 3-[4-(hexadecylamino)phenyl]propanoate

Systemtic Name: 3-oxidanylpropyl 3-[4-(hexadecylamino)phenyl]propanoate Openeye Name: 3-hydroxypropyl 3-[4-(hexadecylamino)phenyl]propanoate CAS Name: 3-[4-(hexadecylamino)phenyl]propanoic acid 3-hydroxypropyl ester IUPAC Name: 3-hydroxypropyl 3-[4-(hexadecylamino)phenyl]propanoate Traditional Name: 3-[4-(cetylamino)phenyl]propionic acid 3-hydroxypropyl ester Formula: C28H49NO3 MolecularWeight: 447.69356

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCNC1=CC=C(C=C1)CCC(=O)OCCCO

Isomeric SMILES

CCCCCCCCCCCCCCCCNC1=CC=C(C=C1)CCC(=O)OCCCO

InChI

InChI=1S/C28H49NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-23-29-27-20-17-26(18-21-27)19-22-28(31)32-25-16-24-30/h17-18,20-21,29-30H,2-16,19,22-25H2,1H3