methyl (E)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-(prop-2-ynylamino)but-2-enoate

Systemtic Name: methyl (E)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-(prop-2-ynylamino)but-2-enoate Openeye Name: methyl (E)-2-(tert-butoxycarbonylamino)-3-(prop-2-ynylamino)but-2-enoate CAS Name: (E)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-3-(prop-2-ynylamino)-2-butenoic acid methyl ester IUPAC Name: methyl (E)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-(prop-2-ynylamino)but-2-enoate Traditional Name: (E)-2-(tert-butoxycarbonylamino)-3-(propargylamino)but-2-enoic acid methyl ester Formula: C13H20N2O4 MolecularWeight: 268.3089

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C(C(=O)OC)NC(=O)OC(C)(C)C)NCC#C

Isomeric SMILES

C/C(=C(/C(=O)OC)\NC(=O)OC(C)(C)C)/NCC#C

InChI

InChI=1S/C13H20N2O4/c1-7-8-14-9(2)10(11(16)18-6)15-12(17)19-13(3,4)5/h1,14H,8H2,2-6H3,(H,15,17)/b10-9+