2-ethanoyl-3-[4-(3-phenylmethoxypropoxy)phenyl]butanoate

Systemtic Name: 2-ethanoyl-3-[4-(3-phenylmethoxypropoxy)phenyl]butanoate Openeye Name: 2-acetyl-3-[4-(3-benzyloxypropoxy)phenyl]butanoate CAS Name: 2-acetyl-3-[4-(3-phenylmethoxypropoxy)phenyl]butanoate IUPAC Name: 2-acetyl-3-[4-(3-phenylmethoxypropoxy)phenyl]butanoate Traditional Name: 2-acetyl-3-[4-(3-benzoxypropoxy)phenyl]butyrate Formula: C22H25O5- MolecularWeight: 369.4309

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)OCCCOCC2=CC=CC=C2)C(C(=O)C)C(=O)[O-]

Isomeric SMILES

CC(C1=CC=C(C=C1)OCCCOCC2=CC=CC=C2)C(C(=O)C)C(=O)[O-]

InChI

InChI=1S/C22H26O5/c1-16(21(17(2)23)22(24)25)19-9-11-20(12-10-19)27-14-6-13-26-15-18-7-4-3-5-8-18/h3-5,7-12,16,21H,6,13-15H2,1-2H3,(H,24,25)/p-1