methyl (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-(6-pyrrolidin-1-ylpyridin-2-yl)propanoate

Systemtic Name: methyl (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-(6-pyrrolidin-1-ylpyridin-2-yl)propanoate Openeye Name: methyl (2S)-2-(tert-butoxycarbonylamino)-3-(6-pyrrolidin-1-yl-2-pyridyl)propanoate CAS Name: (2S)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-3-[6-(1-pyrrolidinyl)-2-pyridinyl]propanoic acid methyl ester IUPAC Name: methyl (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-(6-pyrrolidin-1-ylpyridin-2-yl)propanoate Traditional Name: (2S)-2-(tert-butoxycarbonylamino)-3-(6-pyrrolidino-2-pyridyl)propionic acid methyl ester Formula: C18H27N3O4 MolecularWeight: 349.42468

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=NC(=CC=C1)N2CCCC2)C(=O)OC

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H](CC1=NC(=CC=C1)N2CCCC2)C(=O)OC

InChI

InChI=1S/C18H27N3O4/c1-18(2,3)25-17(23)20-14(16(22)24-4)12-13-8-7-9-15(19-13)21-10-5-6-11-21/h7-9,14H,5-6,10-12H2,1-4H3,(H,20,23)/t14-/m0/s1