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

Systemtic Name: 3-[(2-methylpropan-2-yl)oxycarbonyl-[2-(5-pyridin-2-yl-1-benzofuran-7-yl)ethanoyl]amino]-2-phenyl-piperidine-1-carboxylic acid Openeye Name: 3-[tert-butoxycarbonyl-[2-[5-(2-pyridyl)benzofuran-7-yl]acetyl]amino]-2-phenyl-piperidine-1-carboxylic acid CAS Name: 3-[[(2-methylpropan-2-yl)oxy-oxomethyl]-[1-oxo-2-[5-(2-pyridinyl)-7-benzofuranyl]ethyl]amino]-2-phenyl-1-piperidinecarboxylic acid IUPAC Name: 3-[(2-methylpropan-2-yl)oxycarbonyl-[2-(5-pyridin-2-yl-1-benzofuran-7-yl)acetyl]amino]-2-phenylpiperidine-1-carboxylic acid Traditional Name: 3-[tert-butoxycarbonyl-[2-[5-(2-pyridyl)benzofuran-7-yl]acetyl]amino]-2-phenyl-piperidine-1-carboxylic acid Formula: C32H33N3O6 MolecularWeight: 555.62092

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N(C1CCCN(C1C2=CC=CC=C2)C(=O)O)C(=O)CC3=C4C(=CC(=C3)C5=CC=CC=N5)C=CO4

Isomeric SMILES

CC(C)(C)OC(=O)N(C1CCCN(C1C2=CC=CC=C2)C(=O)O)C(=O)CC3=C4C(=CC(=C3)C5=CC=CC=N5)C=CO4

InChI

InChI=1S/C32H33N3O6/c1-32(2,3)41-31(39)35(26-13-9-16-34(30(37)38)28(26)21-10-5-4-6-11-21)27(36)20-24-19-23(25-12-7-8-15-33-25)18-22-14-17-40-29(22)24/h4-8,10-12,14-15,17-19,26,28H,9,13,16,20H2,1-3H3,(H,37,38)