3-[(2-methylpropan-2-yl)oxycarbonyl-(pyridin-2-ylmethyl)amino]propanoylcarbamoyl hydrogen carbonate

Systemtic Name: 3-[(2-methylpropan-2-yl)oxycarbonyl-(pyridin-2-ylmethyl)amino]propanoylcarbamoyl hydrogen carbonate Openeye Name: 3-[tert-butoxycarbonyl(2-pyridylmethyl)amino]propanoylcarbamoyl hydrogen carbonate CAS Name: carbonic acid [[[3-[[(2-methylpropan-2-yl)oxy-oxomethyl]-(2-pyridinylmethyl)amino]-1-oxopropyl]amino]-oxomethyl] ester IUPAC Name: 3-[(2-methylpropan-2-yl)oxycarbonyl-(pyridin-2-ylmethyl)amino]propanoylcarbamoyl hydrogen carbonate Traditional Name: carbonic acid 3-[tert-butoxycarbonyl(2-pyridylmethyl)amino]propanoylcarbamoyl ester Formula: C16H21N3O7 MolecularWeight: 367.35384

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N(CCC(=O)NC(=O)OC(=O)O)CC1=CC=CC=N1

Isomeric SMILES

CC(C)(C)OC(=O)N(CCC(=O)NC(=O)OC(=O)O)CC1=CC=CC=N1

InChI

InChI=1S/C16H21N3O7/c1-16(2,3)26-14(22)19(10-11-6-4-5-8-17-11)9-7-12(20)18-13(21)25-15(23)24/h4-6,8H,7,9-10H2,1-3H3,(H,23,24)(H,18,20,21)