[(2R)-1-[(4-methoxy-2-nitro-phenyl)amino]-1-oxidanylidene-propan-2-yl] (E)-pent-2-enoate

Systemtic Name: [(2R)-1-[(4-methoxy-2-nitro-phenyl)amino]-1-oxidanylidene-propan-2-yl] (E)-pent-2-enoate Openeye Name: [(1R)-2-(4-methoxy-2-nitro-anilino)-1-methyl-2-oxo-ethyl] (E)-pent-2-enoate CAS Name: (E)-2-pentenoic acid [(2R)-1-(4-methoxy-2-nitroanilino)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(4-methoxy-2-nitroanilino)-1-oxopropan-2-yl] (E)-pent-2-enoate Traditional Name: (E)-pent-2-enoic acid [(1R)-2-keto-2-(4-methoxy-2-nitro-anilino)-1-methyl-ethyl] ester Formula: C15H18N2O6 MolecularWeight: 322.31322

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC=CC(=O)OC(C)C(=O)NC1=C(C=C(C=C1)OC)[N+](=O)[O-]

Isomeric SMILES

CC/C=C/C(=O)O[C@H](C)C(=O)NC1=C(C=C(C=C1)OC)[N+](=O)[O-]

InChI

InChI=1S/C15H18N2O6/c1-4-5-6-14(18)23-10(2)15(19)16-12-8-7-11(22-3)9-13(12)17(20)21/h5-10H,4H2,1-3H3,(H,16,19)/b6-5+/t10-/m1/s1