[2-oxidanylidene-3-(phenylselanylmethyl)-3,4-dihydrochromen-5-yl] octanoate

Systemtic Name: [2-oxidanylidene-3-(phenylselanylmethyl)-3,4-dihydrochromen-5-yl] octanoate Openeye Name: [2-oxo-3-(phenylselanylmethyl)chroman-5-yl] octanoate CAS Name: octanoic acid [2-oxo-3-[(phenylseleno)methyl]-3,4-dihydro-2H-1-benzopyran-5-yl] ester IUPAC Name: [2-oxo-3-(phenylselanylmethyl)-3,4-dihydrochromen-5-yl] octanoate Traditional Name: caprylic acid [2-keto-3-[(phenylseleno)methyl]chroman-5-yl] ester Formula: C24H28O4Se MolecularWeight: 459.43672

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)OC1=CC=CC2=C1CC(C(=O)O2)C[Se]C3=CC=CC=C3

Isomeric SMILES

CCCCCCCC(=O)OC1=CC=CC2=C1CC(C(=O)O2)C[Se]C3=CC=CC=C3

InChI

InChI=1S/C24H28O4Se/c1-2-3-4-5-9-15-23(25)27-21-13-10-14-22-20(21)16-18(24(26)28-22)17-29-19-11-7-6-8-12-19/h6-8,10-14,18H,2-5,9,15-17H2,1H3