tert-butyl 6-[2-methoxy-5-(4-methoxyphenyl)carbonyl-phenyl]hex-5-ynoate

Systemtic Name: tert-butyl 6-[2-methoxy-5-(4-methoxyphenyl)carbonyl-phenyl]hex-5-ynoate Openeye Name: tert-butyl 6-[2-methoxy-5-(4-methoxybenzoyl)phenyl]hex-5-ynoate CAS Name: 6-[2-methoxy-5-[(4-methoxyphenyl)-oxomethyl]phenyl]-5-hexynoic acid tert-butyl ester IUPAC Name: tert-butyl 6-[2-methoxy-5-(4-methoxybenzoyl)phenyl]hex-5-ynoate Traditional Name: 6-(2-methoxy-5-p-anisoyl-phenyl)hex-5-ynoic acid tert-butyl ester Formula: C25H28O5 MolecularWeight: 408.48682

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CCCC#CC1=C(C=CC(=C1)C(=O)C2=CC=C(C=C2)OC)OC

Isomeric SMILES

CC(C)(C)OC(=O)CCCC#CC1=C(C=CC(=C1)C(=O)C2=CC=C(C=C2)OC)OC

InChI

InChI=1S/C25H28O5/c1-25(2,3)30-23(26)10-8-6-7-9-19-17-20(13-16-22(19)29-5)24(27)18-11-14-21(28-4)15-12-18/h11-17H,6,8,10H2,1-5H3