(2-chloranyl-5-nitro-phenyl)methyl (E)-3-phenylprop-2-enoate

Systemtic Name: (2-chloranyl-5-nitro-phenyl)methyl (E)-3-phenylprop-2-enoate Openeye Name: (2-chloro-5-nitro-phenyl)methyl (E)-3-phenylprop-2-enoate CAS Name: (E)-3-phenyl-2-propenoic acid (2-chloro-5-nitrophenyl)methyl ester IUPAC Name: (2-chloro-5-nitrophenyl)methyl (E)-3-phenylprop-2-enoate Traditional Name: (E)-3-phenylacrylic acid (2-chloro-5-nitro-benzyl) ester Formula: C16H12ClNO4 MolecularWeight: 317.72378

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C=CC(=O)OCC2=C(C=CC(=C2)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC=C(C=C1)/C=C/C(=O)OCC2=C(C=CC(=C2)[N+](=O)[O-])Cl

InChI

InChI=1S/C16H12ClNO4/c17-15-8-7-14(18(20)21)10-13(15)11-22-16(19)9-6-12-4-2-1-3-5-12/h1-10H,11H2/b9-6+