tert-butyl 4,4-dimethyl-3-oxidanyl-5-phenylmethoxy-hept-6-ynoate

Systemtic Name: tert-butyl 4,4-dimethyl-3-oxidanyl-5-phenylmethoxy-hept-6-ynoate Openeye Name: tert-butyl 5-benzyloxy-3-hydroxy-4,4-dimethyl-hept-6-ynoate CAS Name: 3-hydroxy-4,4-dimethyl-5-phenylmethoxy-6-heptynoic acid tert-butyl ester IUPAC Name: tert-butyl 3-hydroxy-4,4-dimethyl-5-phenylmethoxyhept-6-ynoate Traditional Name: 5-benzoxy-3-hydroxy-4,4-dimethyl-hept-6-ynoic acid tert-butyl ester Formula: C20H28O4 MolecularWeight: 332.43392

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CC(C(C)(C)C(C#C)OCC1=CC=CC=C1)O

Isomeric SMILES

CC(C)(C)OC(=O)CC(C(C)(C)C(C#C)OCC1=CC=CC=C1)O

InChI

InChI=1S/C20H28O4/c1-7-17(23-14-15-11-9-8-10-12-15)20(5,6)16(21)13-18(22)24-19(2,3)4/h1,8-12,16-17,21H,13-14H2,2-6H3