4-(3-ethoxycarbonylbut-3-en-2-yl)piperidine-1-carboxylic acid

Systemtic Name: 4-(3-ethoxycarbonylbut-3-en-2-yl)piperidine-1-carboxylic acid Openeye Name: 4-(2-ethoxycarbonyl-1-methyl-allyl)piperidine-1-carboxylic acid CAS Name: 4-(3-ethoxycarbonylbut-3-en-2-yl)-1-piperidinecarboxylic acid IUPAC Name: 4-(3-ethoxycarbonylbut-3-en-2-yl)piperidine-1-carboxylic acid Traditional Name: 4-(2-carbethoxy-1-methyl-allyl)piperidine-1-carboxylic acid Formula: C13H21NO4 MolecularWeight: 255.31014

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=C)C(C)C1CCN(CC1)C(=O)O

Isomeric SMILES

CCOC(=O)C(=C)C(C)C1CCN(CC1)C(=O)O

InChI

InChI=1S/C13H21NO4/c1-4-18-12(15)10(3)9(2)11-5-7-14(8-6-11)13(16)17/h9,11H,3-8H2,1-2H3,(H,16,17)