2-[(5-bromanyl-3-methyl-1-benzofuran-2-yl)carbonylamino]-3-oxidanyl-butanoic acid

Systemtic Name: 2-[(5-bromanyl-3-methyl-1-benzofuran-2-yl)carbonylamino]-3-oxidanyl-butanoic acid Openeye Name: 2-[(5-bromo-3-methyl-benzofuran-2-carbonyl)amino]-3-hydroxy-butanoic acid CAS Name: 2-[[(5-bromo-3-methyl-2-benzofuranyl)-oxomethyl]amino]-3-hydroxybutanoic acid IUPAC Name: 2-[(5-bromo-3-methyl-1-benzofuran-2-carbonyl)amino]-3-hydroxybutanoic acid Traditional Name: 2-[(5-bromo-3-methyl-benzofuran-2-carbonyl)amino]-3-hydroxy-butyric acid Formula: C14H14BrNO5 MolecularWeight: 356.16866

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C=C(C=C2)Br)C(=O)NC(C(C)O)C(=O)O

Isomeric SMILES

CC1=C(OC2=C1C=C(C=C2)Br)C(=O)NC(C(C)O)C(=O)O

InChI

InChI=1S/C14H14BrNO5/c1-6-9-5-8(15)3-4-10(9)21-12(6)13(18)16-11(7(2)17)14(19)20/h3-5,7,11,17H,1-2H3,(H,16,18)(H,19,20)