ethyl (3S)-5,5-bis(bromanyl)-3-[(1S)-1-oxidanyl-2-phenylmethoxy-ethyl]pent-4-enoate

Systemtic Name: ethyl (3S)-5,5-bis(bromanyl)-3-[(1S)-1-oxidanyl-2-phenylmethoxy-ethyl]pent-4-enoate Openeye Name: ethyl (3S)-3-[(1S)-2-benzyloxy-1-hydroxy-ethyl]-5,5-dibromo-pent-4-enoate CAS Name: (3S)-5,5-dibromo-3-[(1S)-1-hydroxy-2-phenylmethoxyethyl]-4-pentenoic acid ethyl ester IUPAC Name: ethyl (3S)-5,5-dibromo-3-[(1S)-1-hydroxy-2-phenylmethoxyethyl]pent-4-enoate Traditional Name: (3S)-3-[(1S)-2-benzoxy-1-hydroxy-ethyl]-5,5-dibromo-pent-4-enoic acid ethyl ester Formula: C16H20Br2O4 MolecularWeight: 436.1356

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(C=C(Br)Br)C(COCC1=CC=CC=C1)O

Isomeric SMILES

CCOC(=O)C[C@@H](C=C(Br)Br)[C@@H](COCC1=CC=CC=C1)O

InChI

InChI=1S/C16H20Br2O4/c1-2-22-16(20)9-13(8-15(17)18)14(19)11-21-10-12-6-4-3-5-7-12/h3-8,13-14,19H,2,9-11H2,1H3/t13-,14-/m1/s1