6-[(E)-3-(2-ethenylphenyl)prop-2-enoyl]oxyhexyl phosphate; oxan-2-one

Systemtic Name: 6-[(E)-3-(2-ethenylphenyl)prop-2-enoyl]oxyhexyl phosphate; oxan-2-one Openeye Name: tetrahydropyran-2-one; 6-[(E)-3-(2-vinylphenyl)prop-2-enoyl]oxyhexyl phosphate CAS Name: 6-[(E)-3-(2-ethenylphenyl)-1-oxoprop-2-enoxy]hexyl phosphate; 2-oxanone IUPAC Name: 6-[(E)-3-(2-ethenylphenyl)prop-2-enoyl]oxyhexyl phosphate; oxan-2-one Traditional Name: tetrahydropyran-2-one; 6-[(E)-3-(2-vinylphenyl)acryloyl]oxyhexyl phosphate Formula: C22H29O8P-2 MolecularWeight: 452.434621

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Descriptors Computed from Structure

Canonical SMILES:

C=CC1=CC=CC=C1C=CC(=O)OCCCCCCOP(=O)([O-])[O-].C1CCOC(=O)C1

Isomeric SMILES

C=CC1=CC=CC=C1/C=C/C(=O)OCCCCCCOP(=O)([O-])[O-].C1CCOC(=O)C1

InChI

InChI=1S/C17H23O6P.C5H8O2/c1-2-15-9-5-6-10-16(15)11-12-17(18)22-13-7-3-4-8-14-23-24(19,20)21;6-5-3-1-2-4-7-5/h2,5-6,9-12H,1,3-4,7-8,13-14H2,(H2,19,20,21);1-4H2/p-2/b12-11+;