4-azanyl-4-(1-methyl-2-oxidanylidene-3H-indol-5-yl)butanoic acid

Systemtic Name: 4-azanyl-4-(1-methyl-2-oxidanylidene-3H-indol-5-yl)butanoic acid Openeye Name: 4-amino-4-(1-methyl-2-oxo-indolin-5-yl)butanoic acid CAS Name: 4-amino-4-(1-methyl-2-oxo-3H-indol-5-yl)butanoic acid IUPAC Name: 4-amino-4-(1-methyl-2-oxo-3H-indol-5-yl)butanoic acid Traditional Name: 4-amino-4-(2-keto-1-methyl-indolin-5-yl)butyric acid Formula: C13H16N2O3 MolecularWeight: 248.27774

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)CC2=C1C=CC(=C2)C(CCC(=O)O)N

Isomeric SMILES

CN1C(=O)CC2=C1C=CC(=C2)C(CCC(=O)O)N

InChI

InChI=1S/C13H16N2O3/c1-15-11-4-2-8(6-9(11)7-12(15)16)10(14)3-5-13(17)18/h2,4,6,10H,3,5,7,14H2,1H3,(H,17,18)