trimethyl (4S)-4-[(2-methylpropan-2-yl)oxycarbonylamino]-1-(5-nitropyridin-2-yl)butane-1,1,4-tricarboxylate

Systemtic Name: trimethyl (4S)-4-[(2-methylpropan-2-yl)oxycarbonylamino]-1-(5-nitropyridin-2-yl)butane-1,1,4-tricarboxylate Openeye Name: trimethyl (4S)-4-(tert-butoxycarbonylamino)-1-(5-nitro-2-pyridyl)butane-1,1,4-tricarboxylate CAS Name: (4S)-4-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-(5-nitro-2-pyridinyl)butane-1,1,4-tricarboxylic acid trimethyl ester IUPAC Name: trimethyl (4S)-4-[(2-methylpropan-2-yl)oxycarbonylamino]-1-(5-nitropyridin-2-yl)butane-1,1,4-tricarboxylate Traditional Name: (4S)-4-(tert-butoxycarbonylamino)-1-(5-nitro-2-pyridyl)butane-1,1,4-tricarboxylic acid trimethyl ester Formula: C20H27N3O10 MolecularWeight: 469.44248

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CCC(C1=NC=C(C=C1)[N+](=O)[O-])(C(=O)OC)C(=O)OC)C(=O)OC

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H](CCC(C1=NC=C(C=C1)[N+](=O)[O-])(C(=O)OC)C(=O)OC)C(=O)OC

InChI

InChI=1S/C20H27N3O10/c1-19(2,3)33-18(27)22-13(15(24)30-4)9-10-20(16(25)31-5,17(26)32-6)14-8-7-12(11-21-14)23(28)29/h7-8,11,13H,9-10H2,1-6H3,(H,22,27)/t13-/m0/s1