methyl 2-[4-[(2-methylpropan-2-yl)oxycarbonylamino]morpholin-4-ium-4-yl]hex-4-ynoate

Systemtic Name: methyl 2-[4-[(2-methylpropan-2-yl)oxycarbonylamino]morpholin-4-ium-4-yl]hex-4-ynoate Openeye Name: methyl 2-[4-(tert-butoxycarbonylamino)morpholin-4-ium-4-yl]hex-4-ynoate CAS Name: 2-[4-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-4-morpholin-4-iumyl]-4-hexynoic acid methyl ester IUPAC Name: methyl 2-[4-[(2-methylpropan-2-yl)oxycarbonylamino]morpholin-4-ium-4-yl]hex-4-ynoate Traditional Name: 2-[4-(tert-butoxycarbonylamino)morpholin-4-ium-4-yl]hex-4-ynoic acid methyl ester Formula: C16H27N2O5+ MolecularWeight: 327.39598

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Descriptors Computed from Structure

Canonical SMILES:

CC#CCC(C(=O)OC)[N+]1(CCOCC1)NC(=O)OC(C)(C)C

Isomeric SMILES

CC#CCC(C(=O)OC)[N+]1(CCOCC1)NC(=O)OC(C)(C)C

InChI

InChI=1S/C16H26N2O5/c1-6-7-8-13(14(19)21-5)18(9-11-22-12-10-18)17-15(20)23-16(2,3)4/h13H,8-12H2,1-5H3/p+1