ethyl 3-[4-(3-phenylmethoxyprop-1-ynyl)phenyl]carbonylpentanoate

Systemtic Name: ethyl 3-[4-(3-phenylmethoxyprop-1-ynyl)phenyl]carbonylpentanoate Openeye Name: ethyl 3-[4-(3-benzyloxyprop-1-ynyl)benzoyl]pentanoate CAS Name: 3-[oxo-[4-(3-phenylmethoxyprop-1-ynyl)phenyl]methyl]pentanoic acid ethyl ester IUPAC Name: ethyl 3-[4-(3-phenylmethoxyprop-1-ynyl)benzoyl]pentanoate Traditional Name: 3-[4-(3-benzoxyprop-1-ynyl)benzoyl]valeric acid ethyl ester Formula: C24H26O4 MolecularWeight: 378.46084

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC(=O)OCC)C(=O)C1=CC=C(C=C1)C#CCOCC2=CC=CC=C2

Isomeric SMILES

CCC(CC(=O)OCC)C(=O)C1=CC=C(C=C1)C#CCOCC2=CC=CC=C2

InChI

InChI=1S/C24H26O4/c1-3-21(17-23(25)28-4-2)24(26)22-14-12-19(13-15-22)11-8-16-27-18-20-9-6-5-7-10-20/h5-7,9-10,12-15,21H,3-4,16-18H2,1-2H3