2-methyl-4-oxidanylidene-2-propan-2-yl-4-(thiophen-2-ylmethylamino)butanoic acid

Systemtic Name: 2-methyl-4-oxidanylidene-2-propan-2-yl-4-(thiophen-2-ylmethylamino)butanoic acid Openeye Name: 2-isopropyl-2-methyl-4-oxo-4-(2-thienylmethylamino)butanoic acid CAS Name: 2-methyl-4-oxo-2-propan-2-yl-4-(thiophen-2-ylmethylamino)butanoic acid IUPAC Name: 2-methyl-4-oxo-2-propan-2-yl-4-(thiophen-2-ylmethylamino)butanoic acid Traditional Name: 2-isopropyl-4-keto-2-methyl-4-(2-thenylamino)butyric acid Formula: C13H19NO3S MolecularWeight: 269.35986

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C)(CC(=O)NCC1=CC=CS1)C(=O)O

Isomeric SMILES

CC(C)C(C)(CC(=O)NCC1=CC=CS1)C(=O)O

InChI

InChI=1S/C13H19NO3S/c1-9(2)13(3,12(16)17)7-11(15)14-8-10-5-4-6-18-10/h4-6,9H,7-8H2,1-3H3,(H,14,15)(H,16,17)