methyl 3-(4-hexadecoxy-3-methoxy-phenyl)-3-oxidanylidene-propanoate

Systemtic Name: methyl 3-(4-hexadecoxy-3-methoxy-phenyl)-3-oxidanylidene-propanoate Openeye Name: methyl 3-(4-hexadecoxy-3-methoxy-phenyl)-3-oxo-propanoate CAS Name: 3-(4-hexadecoxy-3-methoxyphenyl)-3-oxopropanoic acid methyl ester IUPAC Name: methyl 3-(4-hexadecoxy-3-methoxyphenyl)-3-oxopropanoate Traditional Name: 3-(4-cetyloxy-3-methoxy-phenyl)-3-keto-propionic acid methyl ester Formula: C27H44O5 MolecularWeight: 448.63526

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOC1=C(C=C(C=C1)C(=O)CC(=O)OC)OC

Isomeric SMILES

CCCCCCCCCCCCCCCCOC1=C(C=C(C=C1)C(=O)CC(=O)OC)OC

InChI

InChI=1S/C27H44O5/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20-32-25-19-18-23(21-26(25)30-2)24(28)22-27(29)31-3/h18-19,21H,4-17,20,22H2,1-3H3