3-acetamido-1-(2-oxidanylidenepropyl)indole-2-carboxylic acid

Systemtic Name: 3-acetamido-1-(2-oxidanylidenepropyl)indole-2-carboxylic acid Openeye Name: 3-acetamido-1-acetonyl-indole-2-carboxylic acid CAS Name: 3-acetamido-1-(2-oxopropyl)-2-indolecarboxylic acid IUPAC Name: 3-acetamido-1-(2-oxopropyl)indole-2-carboxylic acid Traditional Name: 3-acetamido-1-acetonyl-indole-2-carboxylic acid Formula: C14H14N2O4 MolecularWeight: 274.27196

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CN1C2=CC=CC=C2C(=C1C(=O)O)NC(=O)C

Isomeric SMILES

CC(=O)CN1C2=CC=CC=C2C(=C1C(=O)O)NC(=O)C

InChI

InChI=1S/C14H14N2O4/c1-8(17)7-16-11-6-4-3-5-10(11)12(15-9(2)18)13(16)14(19)20/h3-6H,7H2,1-2H3,(H,15,18)(H,19,20)