methyl 3-[(2R,3R)-2-acetyloxy-3-formamido-3-(methoxymethyl)-6,7-dimethyl-oct-6-enyl]-4-bromanyl-benzoate

Systemtic Name: methyl 3-[(2R,3R)-2-acetyloxy-3-formamido-3-(methoxymethyl)-6,7-dimethyl-oct-6-enyl]-4-bromanyl-benzoate Openeye Name: methyl 3-[(2R,3R)-2-acetoxy-3-formamido-3-(methoxymethyl)-6,7-dimethyl-oct-6-enyl]-4-bromo-benzoate CAS Name: 3-[(2R,3R)-2-acetyloxy-3-formamido-3-(methoxymethyl)-6,7-dimethyloct-6-enyl]-4-bromobenzoic acid methyl ester IUPAC Name: methyl 3-[(2R,3R)-2-acetyloxy-3-formamido-3-(methoxymethyl)-6,7-dimethyloct-6-enyl]-4-bromobenzoate Traditional Name: 3-[(2R,3R)-2-acetoxy-3-formamido-3-(methoxymethyl)-6,7-dimethyl-oct-6-enyl]-4-bromo-benzoic acid methyl ester Formula: C23H32BrNO6 MolecularWeight: 498.40728

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C(C)CCC(COC)(C(CC1=C(C=CC(=C1)C(=O)OC)Br)OC(=O)C)NC=O)C

Isomeric SMILES

CC(=C(C)CC[C@@](COC)([C@@H](CC1=C(C=CC(=C1)C(=O)OC)Br)OC(=O)C)NC=O)C

InChI

InChI=1S/C23H32BrNO6/c1-15(2)16(3)9-10-23(13-29-5,25-14-26)21(31-17(4)27)12-19-11-18(22(28)30-6)7-8-20(19)24/h7-8,11,14,21H,9-10,12-13H2,1-6H3,(H,25,26)/t21-,23-/m1/s1