(3R,4R)-3-[5-bromanyl-2-(prop-2-ynylamino)phenyl]-4-methyl-3-oxidanyl-oxolan-2-one

Systemtic Name: (3R,4R)-3-[5-bromanyl-2-(prop-2-ynylamino)phenyl]-4-methyl-3-oxidanyl-oxolan-2-one Openeye Name: (3R,4R)-3-[5-bromo-2-(prop-2-ynylamino)phenyl]-3-hydroxy-4-methyl-tetrahydrofuran-2-one CAS Name: (3R,4R)-3-[5-bromo-2-(prop-2-ynylamino)phenyl]-3-hydroxy-4-methyl-2-oxolanone IUPAC Name: (3R,4R)-3-[5-bromo-2-(prop-2-ynylamino)phenyl]-3-hydroxy-4-methyloxolan-2-one Traditional Name: (3R,4R)-3-[5-bromo-2-(propargylamino)phenyl]-3-hydroxy-4-methyl-tetrahydrofuran-2-one Formula: C14H14BrNO3 MolecularWeight: 324.16986

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Descriptors Computed from Structure

Canonical SMILES:

CC1COC(=O)C1(C2=C(C=CC(=C2)Br)NCC#C)O

Isomeric SMILES

C[C@@H]1COC(=O)[C@@]1(C2=C(C=CC(=C2)Br)NCC#C)O

InChI

InChI=1S/C14H14BrNO3/c1-3-6-16-12-5-4-10(15)7-11(12)14(18)9(2)8-19-13(14)17/h1,4-5,7,9,16,18H,6,8H2,2H3/t9-,14-/m1/s1