[(2R)-1-methoxypropan-2-yl] (E)-2-cyano-3-(4-methyl-3-nitro-phenyl)prop-2-enoate

Systemtic Name: [(2R)-1-methoxypropan-2-yl] (E)-2-cyano-3-(4-methyl-3-nitro-phenyl)prop-2-enoate Openeye Name: [(1R)-2-methoxy-1-methyl-ethyl] (E)-2-cyano-3-(4-methyl-3-nitro-phenyl)prop-2-enoate CAS Name: (E)-2-cyano-3-(4-methyl-3-nitrophenyl)-2-propenoic acid [(2R)-1-methoxypropan-2-yl] ester IUPAC Name: [(2R)-1-methoxypropan-2-yl] (E)-2-cyano-3-(4-methyl-3-nitrophenyl)prop-2-enoate Traditional Name: (E)-2-cyano-3-(4-methyl-3-nitro-phenyl)acrylic acid [(1R)-2-methoxy-1-methyl-ethyl] ester Formula: C15H16N2O5 MolecularWeight: 304.29794

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C=C(C#N)C(=O)OC(C)COC)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)/C=C(\C#N)/C(=O)O[C@H](C)COC)[N+](=O)[O-]

InChI

InChI=1S/C15H16N2O5/c1-10-4-5-12(7-14(10)17(19)20)6-13(8-16)15(18)22-11(2)9-21-3/h4-7,11H,9H2,1-3H3/b13-6+/t11-/m1/s1