4-[(2,3-dimethyl-2,3-dihydro-1-benzofuran-7-yl)carbonyl-methyl-amino]butanoic acid

Systemtic Name: 4-[(2,3-dimethyl-2,3-dihydro-1-benzofuran-7-yl)carbonyl-methyl-amino]butanoic acid Openeye Name: 4-[(2,3-dimethyl-2,3-dihydrobenzofuran-7-carbonyl)-methyl-amino]butanoic acid CAS Name: 4-[[(2,3-dimethyl-2,3-dihydrobenzofuran-7-yl)-oxomethyl]-methylamino]butanoic acid IUPAC Name: 4-[(2,3-dimethyl-2,3-dihydro-1-benzofuran-7-carbonyl)-methylamino]butanoic acid Traditional Name: 4-[(2,3-dimethylcoumaran-7-carbonyl)-methyl-amino]butyric acid Formula: C16H21NO4 MolecularWeight: 291.34224

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1C(OC2=C(C=CC=C12)C(=O)N(C)CCCC(=O)O)C

Isomeric SMILES

CC1C(OC2=C(C=CC=C12)C(=O)N(C)CCCC(=O)O)C

InChI

InChI=1S/C16H21NO4/c1-10-11(2)21-15-12(10)6-4-7-13(15)16(20)17(3)9-5-8-14(18)19/h4,6-7,10-11H,5,8-9H2,1-3H3,(H,18,19)