3-[(2-methylpropan-2-yl)oxycarbonyl-[2-(5-pyridin-2-yl-1-benzofuran-7-yl)ethanoyl]amino]piperidine-1-carboxylic acid

Systemtic Name: 3-[(2-methylpropan-2-yl)oxycarbonyl-[2-(5-pyridin-2-yl-1-benzofuran-7-yl)ethanoyl]amino]piperidine-1-carboxylic acid Openeye Name: 3-[tert-butoxycarbonyl-[2-[5-(2-pyridyl)benzofuran-7-yl]acetyl]amino]piperidine-1-carboxylic acid CAS Name: 3-[[(2-methylpropan-2-yl)oxy-oxomethyl]-[1-oxo-2-[5-(2-pyridinyl)-7-benzofuranyl]ethyl]amino]-1-piperidinecarboxylic acid IUPAC Name: 3-[(2-methylpropan-2-yl)oxycarbonyl-[2-(5-pyridin-2-yl-1-benzofuran-7-yl)acetyl]amino]piperidine-1-carboxylic acid Traditional Name: 3-[tert-butoxycarbonyl-[2-[5-(2-pyridyl)benzofuran-7-yl]acetyl]amino]piperidine-1-carboxylic acid Formula: C26H29N3O6 MolecularWeight: 479.52496

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N(C1CCCN(C1)C(=O)O)C(=O)CC2=C3C(=CC(=C2)C4=CC=CC=N4)C=CO3

Isomeric SMILES

CC(C)(C)OC(=O)N(C1CCCN(C1)C(=O)O)C(=O)CC2=C3C(=CC(=C2)C4=CC=CC=N4)C=CO3

InChI

InChI=1S/C26H29N3O6/c1-26(2,3)35-25(33)29(20-7-6-11-28(16-20)24(31)32)22(30)15-19-14-18(21-8-4-5-10-27-21)13-17-9-12-34-23(17)19/h4-5,8-10,12-14,20H,6-7,11,15-16H2,1-3H3,(H,31,32)