methyl (E)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-(4-nitrophenyl)sulfinyloxy-prop-2-enoate

Systemtic Name: methyl (E)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-(4-nitrophenyl)sulfinyloxy-prop-2-enoate Openeye Name: methyl (E)-2-(tert-butoxycarbonylamino)-3-(4-nitrophenyl)sulfinyloxy-prop-2-enoate CAS Name: (E)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-3-(4-nitrophenyl)sulfinyloxy-2-propenoic acid methyl ester IUPAC Name: methyl (E)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-(4-nitrophenyl)sulfinyloxyprop-2-enoate Traditional Name: (E)-2-(tert-butoxycarbonylamino)-3-(4-nitrophenyl)sulfinyloxy-acrylic acid methyl ester Formula: C15H18N2O8S MolecularWeight: 386.37702

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(C)(C)OC(=O)N/C(=C/OS(=O)C1=CC=C(C=C1)[N+](=O)[O-])/C(=O)OC

InChI

InChI=1S/C15H18N2O8S/c1-15(2,3)25-14(19)16-12(13(18)23-4)9-24-26(22)11-7-5-10(6-8-11)17(20)21/h5-9H,1-4H3,(H,16,19)/b12-9+