(Z)-4-[[(2-methylpropan-2-yl)oxycarbonylamino]-prop-2-enyl-amino]-4-oxidanylidene-but-2-enoic acid

Systemtic Name: (Z)-4-[[(2-methylpropan-2-yl)oxycarbonylamino]-prop-2-enyl-amino]-4-oxidanylidene-but-2-enoic acid Openeye Name: (Z)-4-[allyl-(tert-butoxycarbonylamino)amino]-4-oxo-but-2-enoic acid CAS Name: (Z)-4-[[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-prop-2-enylamino]-4-oxo-2-butenoic acid IUPAC Name: (Z)-4-[[(2-methylpropan-2-yl)oxycarbonylamino]-prop-2-enylamino]-4-oxobut-2-enoic acid Traditional Name: (Z)-4-[allyl-(tert-butoxycarbonylamino)amino]-4-keto-but-2-enoic acid Formula: C12H18N2O5 MolecularWeight: 270.28172

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NN(CC=C)C(=O)C=CC(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)NN(CC=C)C(=O)/C=C\C(=O)O

InChI

InChI=1S/C12H18N2O5/c1-5-8-14(9(15)6-7-10(16)17)13-11(18)19-12(2,3)4/h5-7H,1,8H2,2-4H3,(H,13,18)(H,16,17)/b7-6-