Se-[(E)-2-(cyclohexen-1-yl)-2-diphenylarsanyl-ethenyl] 4-methylbenzenecarboselenoate

Systemtic Name: Se-[(E)-2-(cyclohexen-1-yl)-2-diphenylarsanyl-ethenyl] 4-methylbenzenecarboselenoate Openeye Name: Se-[(E)-2-(cyclohexen-1-yl)-2-diphenylarsanyl-vinyl] 4-methylbenzenecarboselenoate CAS Name: 4-methylbenzenecarboselenoic acid Se-[(E)-2-(1-cyclohexenyl)-2-diphenylarsinoethenyl] ester IUPAC Name: Se-[(E)-2-(cyclohexen-1-yl)-2-diphenylarsanylethenyl] 4-methylbenzenecarboselenoate Traditional Name: 4-methylselenobenzoic acid Se-[(E)-2-(cyclohexen-1-yl)-2-diphenylarsino-vinyl] ester Formula: C28H27AsOSe MolecularWeight: 533.39498

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)[Se]C=C(C2=CCCCC2)[As](C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)[Se]/C=C(\C2=CCCCC2)/[As](C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C28H27AsOSe/c1-22-17-19-24(20-18-22)28(30)31-21-27(23-11-5-2-6-12-23)29(25-13-7-3-8-14-25)26-15-9-4-10-16-26/h3-4,7-11,13-21H,2,5-6,12H2,1H3/b27-21+