2-azanyl-3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate; 4-methylbenzenesulfonic acid

Systemtic Name: 2-azanyl-3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate; 4-methylbenzenesulfonic acid Openeye Name: 2-amino-3-(tert-butoxycarbonylamino)propanoate; 4-methylbenzenesulfonic acid CAS Name: 2-amino-3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propanoate; 4-methylbenzenesulfonic acid IUPAC Name: 2-amino-3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate; 4-methylbenzenesulfonic acid Traditional Name: 2-amino-3-(tert-butoxycarbonylamino)propionate; tosylic acid Formula: C15H23N2O7S- MolecularWeight: 375.41732

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)O.CC(C)(C)OC(=O)NCC(C(=O)[O-])N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)O.CC(C)(C)OC(=O)NCC(C(=O)[O-])N

InChI

InChI=1S/C8H16N2O4.C7H8O3S/c1-8(2,3)14-7(13)10-4-5(9)6(11)12;1-6-2-4-7(5-3-6)11(8,9)10/h5H,4,9H2,1-3H3,(H,10,13)(H,11,12);2-5H,1H3,(H,8,9,10)/p-1