ethyl 3-[4-(heptadecylamino)phenyl]propanoate

Systemtic Name: ethyl 3-[4-(heptadecylamino)phenyl]propanoate Openeye Name: ethyl 3-[4-(heptadecylamino)phenyl]propanoate CAS Name: 3-[4-(heptadecylamino)phenyl]propanoic acid ethyl ester IUPAC Name: ethyl 3-[4-(heptadecylamino)phenyl]propanoate Traditional Name: 3-[4-(heptadecylamino)phenyl]propionic acid ethyl ester Formula: C28H49NO2 MolecularWeight: 431.69416

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCNC1=CC=C(C=C1)CCC(=O)OCC

Isomeric SMILES

CCCCCCCCCCCCCCCCCNC1=CC=C(C=C1)CCC(=O)OCC

InChI

InChI=1S/C28H49NO2/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-25-29-27-22-19-26(20-23-27)21-24-28(30)31-4-2/h19-20,22-23,29H,3-18,21,24-25H2,1-2H3