4-[(5-bromanyl-3-methyl-1-benzofuran-2-yl)carbonyl-methyl-amino]butanoic acid

Systemtic Name: 4-[(5-bromanyl-3-methyl-1-benzofuran-2-yl)carbonyl-methyl-amino]butanoic acid Openeye Name: 4-[(5-bromo-3-methyl-benzofuran-2-carbonyl)-methyl-amino]butanoic acid CAS Name: 4-[[(5-bromo-3-methyl-2-benzofuranyl)-oxomethyl]-methylamino]butanoic acid IUPAC Name: 4-[(5-bromo-3-methyl-1-benzofuran-2-carbonyl)-methylamino]butanoic acid Traditional Name: 4-[(5-bromo-3-methyl-benzofuran-2-carbonyl)-methyl-amino]butyric acid Formula: C15H16BrNO4 MolecularWeight: 354.19584

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C=C(C=C2)Br)C(=O)N(C)CCCC(=O)O

Isomeric SMILES

CC1=C(OC2=C1C=C(C=C2)Br)C(=O)N(C)CCCC(=O)O

InChI

InChI=1S/C15H16BrNO4/c1-9-11-8-10(16)5-6-12(11)21-14(9)15(20)17(2)7-3-4-13(18)19/h5-6,8H,3-4,7H2,1-2H3,(H,18,19)