methyl 7-[4-(2-acetamidoethyl)phenyl]-7-oxidanylidene-heptanoate

Systemtic Name: methyl 7-[4-(2-acetamidoethyl)phenyl]-7-oxidanylidene-heptanoate Openeye Name: methyl 7-[4-(2-acetamidoethyl)phenyl]-7-oxo-heptanoate CAS Name: 7-[4-(2-acetamidoethyl)phenyl]-7-oxoheptanoic acid methyl ester IUPAC Name: methyl 7-[4-(2-acetamidoethyl)phenyl]-7-oxoheptanoate Traditional Name: 7-[4-(2-acetamidoethyl)phenyl]-7-keto-enanthic acid methyl ester Formula: C18H25NO4 MolecularWeight: 319.3954

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H25NO4/c1-14(20)19-13-12-15-8-10-16(11-9-15)17(21)6-4-3-5-7-18(22)23-2/h8-11H,3-7,12-13H2,1-2H3,(H,19,20)