(E)-4-(3-tert-butyl-4-oxidanyl-5,6,7,8-tetrahydronaphthalen-1-yl)-1-diethoxyphosphoryl-but-3-en-2-one

Systemtic Name: (E)-4-(3-tert-butyl-4-oxidanyl-5,6,7,8-tetrahydronaphthalen-1-yl)-1-diethoxyphosphoryl-but-3-en-2-one Openeye Name: (E)-4-(7-tert-butyl-8-hydroxy-tetralin-5-yl)-1-diethoxyphosphoryl-but-3-en-2-one CAS Name: (E)-4-(3-tert-butyl-4-hydroxy-5,6,7,8-tetrahydronaphthalen-1-yl)-1-diethoxyphosphoryl-3-buten-2-one IUPAC Name: (E)-4-(3-tert-butyl-4-hydroxy-5,6,7,8-tetrahydronaphthalen-1-yl)-1-diethoxyphosphorylbut-3-en-2-one Traditional Name: (E)-4-(7-tert-butyl-8-hydroxy-tetralin-5-yl)-1-diethoxyphosphoryl-but-3-en-2-one Formula: C22H33O5P MolecularWeight: 408.468181

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(CC(=O)C=CC1=CC(=C(C2=C1CCCC2)O)C(C)(C)C)OCC

Isomeric SMILES

CCOP(=O)(CC(=O)/C=C/C1=CC(=C(C2=C1CCCC2)O)C(C)(C)C)OCC

InChI

InChI=1S/C22H33O5P/c1-6-26-28(25,27-7-2)15-17(23)13-12-16-14-20(22(3,4)5)21(24)19-11-9-8-10-18(16)19/h12-14,24H,6-11,15H2,1-5H3/b13-12+