bis[(1R,2S)-2-phenylcyclohexyl] (3S)-3-methyl-2-phenylselanyl-2-prop-2-enyl-butanedioate

Systemtic Name: bis[(1R,2S)-2-phenylcyclohexyl] (3S)-3-methyl-2-phenylselanyl-2-prop-2-enyl-butanedioate Openeye Name: bis[(1R,2S)-2-phenylcyclohexyl] (3S)-2-allyl-3-methyl-2-phenylselanyl-butanedioate CAS Name: (3S)-3-methyl-2-(phenylseleno)-2-prop-2-enylbutanedioic acid bis[(1R,2S)-2-phenylcyclohexyl] ester IUPAC Name: bis[(1R,2S)-2-phenylcyclohexyl] (3S)-3-methyl-2-phenylselanyl-2-prop-2-enylbutanedioate Traditional Name: (3S)-2-allyl-3-methyl-2-(phenylseleno)succinic acid bis[(1R,2S)-2-phenylcyclohexyl] ester Formula: C38H44O4Se MolecularWeight: 643.71356

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC1CCCCC1C2=CC=CC=C2)C(CC=C)(C(=O)OC3CCCCC3C4=CC=CC=C4)[Se]C5=CC=CC=C5

Isomeric SMILES

C[C@@H](C(=O)O[C@@H]1CCCC[C@H]1C2=CC=CC=C2)C(CC=C)(C(=O)O[C@@H]3CCCC[C@H]3C4=CC=CC=C4)[Se]C5=CC=CC=C5

InChI

InChI=1S/C38H44O4Se/c1-3-27-38(43-31-21-11-6-12-22-31,37(40)42-35-26-16-14-24-33(35)30-19-9-5-10-20-30)28(2)36(39)41-34-25-15-13-23-32(34)29-17-7-4-8-18-29/h3-12,17-22,28,32-35H,1,13-16,23-27H2,2H3/t28-,32-,33-,34+,35+,38?/m0/s1