methyl 8-[4-(2-acetamidoethyl)phenyl]-8-oxidanylidene-octanoate

Systemtic Name: methyl 8-[4-(2-acetamidoethyl)phenyl]-8-oxidanylidene-octanoate Openeye Name: methyl 8-[4-(2-acetamidoethyl)phenyl]-8-oxo-octanoate CAS Name: 8-[4-(2-acetamidoethyl)phenyl]-8-oxooctanoic acid methyl ester IUPAC Name: methyl 8-[4-(2-acetamidoethyl)phenyl]-8-oxooctanoate Traditional Name: 8-[4-(2-acetamidoethyl)phenyl]-8-keto-caprylic acid methyl ester Formula: C19H27NO4 MolecularWeight: 333.42198

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCCC1=CC=C(C=C1)C(=O)CCCCCCC(=O)OC

Isomeric SMILES

CC(=O)NCCC1=CC=C(C=C1)C(=O)CCCCCCC(=O)OC

InChI

InChI=1S/C19H27NO4/c1-15(21)20-14-13-16-9-11-17(12-10-16)18(22)7-5-3-4-6-8-19(23)24-2/h9-12H,3-8,13-14H2,1-2H3,(H,20,21)