[(1S)-1-(2-chlorophenyl)ethyl] (E)-3-(5-nitrofuran-2-yl)prop-2-enoate

Systemtic Name: [(1S)-1-(2-chlorophenyl)ethyl] (E)-3-(5-nitrofuran-2-yl)prop-2-enoate Openeye Name: [(1S)-1-(2-chlorophenyl)ethyl] (E)-3-(5-nitro-2-furyl)prop-2-enoate CAS Name: (E)-3-(5-nitro-2-furanyl)-2-propenoic acid [(1S)-1-(2-chlorophenyl)ethyl] ester IUPAC Name: [(1S)-1-(2-chlorophenyl)ethyl] (E)-3-(5-nitrofuran-2-yl)prop-2-enoate Traditional Name: (E)-3-(5-nitro-2-furyl)acrylic acid [(1S)-1-(2-chlorophenyl)ethyl] ester Formula: C15H12ClNO5 MolecularWeight: 321.71248

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1Cl)OC(=O)C=CC2=CC=C(O2)[N+](=O)[O-]

Isomeric SMILES

C[C@@H](C1=CC=CC=C1Cl)OC(=O)/C=C/C2=CC=C(O2)[N+](=O)[O-]

InChI

InChI=1S/C15H12ClNO5/c1-10(12-4-2-3-5-13(12)16)21-15(18)9-7-11-6-8-14(22-11)17(19)20/h2-10H,1H3/b9-7+/t10-/m0/s1