4-[(2,3-dimethyl-1H-indol-5-yl)carbonyl-methyl-amino]butanoic acid

Systemtic Name: 4-[(2,3-dimethyl-1H-indol-5-yl)carbonyl-methyl-amino]butanoic acid Openeye Name: 4-[(2,3-dimethyl-1H-indole-5-carbonyl)-methyl-amino]butanoic acid CAS Name: 4-[[(2,3-dimethyl-1H-indol-5-yl)-oxomethyl]-methylamino]butanoic acid IUPAC Name: 4-[(2,3-dimethyl-1H-indole-5-carbonyl)-methylamino]butanoic acid Traditional Name: 4-[(2,3-dimethyl-1H-indole-5-carbonyl)-methyl-amino]butyric acid Formula: C16H20N2O3 MolecularWeight: 288.3416

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC2=C1C=C(C=C2)C(=O)N(C)CCCC(=O)O)C

Isomeric SMILES

CC1=C(NC2=C1C=C(C=C2)C(=O)N(C)CCCC(=O)O)C

InChI

InChI=1S/C16H20N2O3/c1-10-11(2)17-14-7-6-12(9-13(10)14)16(21)18(3)8-4-5-15(19)20/h6-7,9,17H,4-5,8H2,1-3H3,(H,19,20)