8-[[(2-methylpropan-2-yl)oxycarbonyl-pyridin-2-yl-amino]methyl]-4-oxa-3-azaspiro[4.5]dec-2-ene-2-carboxylic acid

Systemtic Name: 8-[[(2-methylpropan-2-yl)oxycarbonyl-pyridin-2-yl-amino]methyl]-4-oxa-3-azaspiro[4.5]dec-2-ene-2-carboxylic acid Openeye Name: 8-[[tert-butoxycarbonyl(2-pyridyl)amino]methyl]-4-oxa-3-azaspiro[4.5]dec-2-ene-2-carboxylic acid CAS Name: 8-[[[(2-methylpropan-2-yl)oxy-oxomethyl]-(2-pyridinyl)amino]methyl]-4-oxa-3-azaspiro[4.5]dec-2-ene-2-carboxylic acid IUPAC Name: 8-[[(2-methylpropan-2-yl)oxycarbonyl-pyridin-2-ylamino]methyl]-4-oxa-3-azaspiro[4.5]dec-2-ene-2-carboxylic acid Traditional Name: 8-[[tert-butoxycarbonyl(2-pyridyl)amino]methyl]-4-oxa-3-azaspiro[4.5]dec-2-ene-2-carboxylic acid Formula: C20H27N3O5 MolecularWeight: 389.44548

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N(CC1CCC2(CC1)CC(=NO2)C(=O)O)C3=CC=CC=N3

Isomeric SMILES

CC(C)(C)OC(=O)N(CC1CCC2(CC1)CC(=NO2)C(=O)O)C3=CC=CC=N3

InChI

InChI=1S/C20H27N3O5/c1-19(2,3)27-18(26)23(16-6-4-5-11-21-16)13-14-7-9-20(10-8-14)12-15(17(24)25)22-28-20/h4-6,11,14H,7-10,12-13H2,1-3H3,(H,24,25)