[(2R)-1-oxidanylidene-1-(2-thiophen-2-ylethylamino)propan-2-yl] (E)-3-(4-nitrophenyl)prop-2-enoate

Systemtic Name: [(2R)-1-oxidanylidene-1-(2-thiophen-2-ylethylamino)propan-2-yl] (E)-3-(4-nitrophenyl)prop-2-enoate Openeye Name: [(1R)-1-methyl-2-oxo-2-[2-(2-thienyl)ethylamino]ethyl] (E)-3-(4-nitrophenyl)prop-2-enoate CAS Name: (E)-3-(4-nitrophenyl)-2-propenoic acid [(2R)-1-oxo-1-(2-thiophen-2-ylethylamino)propan-2-yl] ester IUPAC Name: [(2R)-1-oxo-1-(2-thiophen-2-ylethylamino)propan-2-yl] (E)-3-(4-nitrophenyl)prop-2-enoate Traditional Name: (E)-3-(4-nitrophenyl)acrylic acid [(1R)-2-keto-1-methyl-2-[2-(2-thienyl)ethylamino]ethyl] ester Formula: C18H18N2O5S MolecularWeight: 374.41092

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCCC1=CC=CS1)OC(=O)C=CC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C[C@H](C(=O)NCCC1=CC=CS1)OC(=O)/C=C/C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C18H18N2O5S/c1-13(18(22)19-11-10-16-3-2-12-26-16)25-17(21)9-6-14-4-7-15(8-5-14)20(23)24/h2-9,12-13H,10-11H2,1H3,(H,19,22)/b9-6+/t13-/m1/s1