methyl 3-[4-(6-acetamidohexanoyl)phenyl]propanoate

Systemtic Name: methyl 3-[4-(6-acetamidohexanoyl)phenyl]propanoate Openeye Name: methyl 3-[4-(6-acetamidohexanoyl)phenyl]propanoate CAS Name: 3-[4-(6-acetamido-1-oxohexyl)phenyl]propanoic acid methyl ester IUPAC Name: methyl 3-[4-(6-acetamidohexanoyl)phenyl]propanoate Traditional Name: 3-[4-(6-acetamidohexanoyl)phenyl]propionic acid methyl ester Formula: C18H25NO4 MolecularWeight: 319.3954

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCCCCCC(=O)C1=CC=C(C=C1)CCC(=O)OC

Isomeric SMILES

CC(=O)NCCCCCC(=O)C1=CC=C(C=C1)CCC(=O)OC

InChI

InChI=1S/C18H25NO4/c1-14(20)19-13-5-3-4-6-17(21)16-10-7-15(8-11-16)9-12-18(22)23-2/h7-8,10-11H,3-6,9,12-13H2,1-2H3,(H,19,20)