hexyl 3-[4-(6-azanylhexanoyl)phenyl]propanoate

Systemtic Name: hexyl 3-[4-(6-azanylhexanoyl)phenyl]propanoate Openeye Name: hexyl 3-[4-(6-aminohexanoyl)phenyl]propanoate CAS Name: 3-[4-(6-amino-1-oxohexyl)phenyl]propanoic acid hexyl ester IUPAC Name: hexyl 3-[4-(6-aminohexanoyl)phenyl]propanoate Traditional Name: 3-[4-(6-aminohexanoyl)phenyl]propionic acid hexyl ester Formula: C21H33NO3 MolecularWeight: 347.49162

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)CCC1=CC=C(C=C1)C(=O)CCCCCN

Isomeric SMILES

CCCCCCOC(=O)CCC1=CC=C(C=C1)C(=O)CCCCCN

InChI

InChI=1S/C21H33NO3/c1-2-3-4-8-17-25-21(24)15-12-18-10-13-19(14-11-18)20(23)9-6-5-7-16-22/h10-11,13-14H,2-9,12,15-17,22H2,1H3