methyl (4R,5R,8S,12R)-2-bromanyl-8,12-dimethyl-15-oxidanylidene-4,7-bis(phenylmethoxy)-5-propan-2-yl-pentadecanoate

Systemtic Name: methyl (4R,5R,8S,12R)-2-bromanyl-8,12-dimethyl-15-oxidanylidene-4,7-bis(phenylmethoxy)-5-propan-2-yl-pentadecanoate Openeye Name: methyl (4R,5R,8S,12R)-4,7-dibenzyloxy-2-bromo-5-isopropyl-8,12-dimethyl-15-oxo-pentadecanoate CAS Name: (4R,5R,8S,12R)-2-bromo-8,12-dimethyl-15-oxo-4,7-bis(phenylmethoxy)-5-propan-2-ylpentadecanoic acid methyl ester IUPAC Name: methyl (4R,5R,8S,12R)-2-bromo-8,12-dimethyl-15-oxo-4,7-bis(phenylmethoxy)-5-propan-2-ylpentadecanoate Traditional Name: (4R,5R,8S,12R)-4,7-dibenzoxy-2-bromo-5-isopropyl-15-keto-8,12-dimethyl-pentadecanoic acid methyl ester Formula: C35H51BrO5 MolecularWeight: 631.68044

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CC(C(C)CCCC(C)CCC=O)OCC1=CC=CC=C1)C(CC(C(=O)OC)Br)OCC2=CC=CC=C2

Isomeric SMILES

C[C@H](CCC[C@H](C)C(C[C@@H]([C@@H](CC(C(=O)OC)Br)OCC1=CC=CC=C1)C(C)C)OCC2=CC=CC=C2)CCC=O

InChI

InChI=1S/C35H51BrO5/c1-26(2)31(34(23-32(36)35(38)39-5)41-25-30-19-10-7-11-20-30)22-33(40-24-29-17-8-6-9-18-29)28(4)16-12-14-27(3)15-13-21-37/h6-11,17-21,26-28,31-34H,12-16,22-25H2,1-5H3/t27-,28+,31-,32?,33?,34-/m1/s1