phenyl 5-oxidanyl-5-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)pent-3-ynoate

Systemtic Name: phenyl 5-oxidanyl-5-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)pent-3-ynoate Openeye Name: phenyl 5-hydroxy-5-(1,1,4,4,7-pentamethyltetralin-6-yl)pent-3-ynoate CAS Name: 5-hydroxy-5-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)-3-pentynoic acid phenyl ester IUPAC Name: phenyl 5-hydroxy-5-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)pent-3-ynoate Traditional Name: 5-hydroxy-5-(1,1,4,4,7-pentamethyltetralin-6-yl)pent-3-ynoic acid phenyl ester Formula: C26H30O3 MolecularWeight: 390.5146

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(CCC2(C)C)(C)C)C(C#CCC(=O)OC3=CC=CC=C3)O

Isomeric SMILES

CC1=C(C=C2C(=C1)C(CCC2(C)C)(C)C)C(C#CCC(=O)OC3=CC=CC=C3)O

InChI

InChI=1S/C26H30O3/c1-18-16-21-22(26(4,5)15-14-25(21,2)3)17-20(18)23(27)12-9-13-24(28)29-19-10-7-6-8-11-19/h6-8,10-11,16-17,23,27H,13-15H2,1-5H3