tert-butyl 4-oxidanylidene-7-phenylmethoxy-hept-5-ynoate

Systemtic Name: tert-butyl 4-oxidanylidene-7-phenylmethoxy-hept-5-ynoate Openeye Name: tert-butyl 7-benzyloxy-4-oxo-hept-5-ynoate CAS Name: 4-oxo-7-phenylmethoxy-5-heptynoic acid tert-butyl ester IUPAC Name: tert-butyl 4-oxo-7-phenylmethoxyhept-5-ynoate Traditional Name: 7-benzoxy-4-keto-hept-5-ynoic acid tert-butyl ester Formula: C18H22O4 MolecularWeight: 302.36488

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CCC(=O)C#CCOCC1=CC=CC=C1

Isomeric SMILES

CC(C)(C)OC(=O)CCC(=O)C#CCOCC1=CC=CC=C1

InChI

InChI=1S/C18H22O4/c1-18(2,3)22-17(20)12-11-16(19)10-7-13-21-14-15-8-5-4-6-9-15/h4-6,8-9H,11-14H2,1-3H3