ethyl (E)-3-[4-(2-chloranylphenoxy)-3-nitro-phenyl]-2-cyano-prop-2-enoate

Systemtic Name: ethyl (E)-3-[4-(2-chloranylphenoxy)-3-nitro-phenyl]-2-cyano-prop-2-enoate Openeye Name: ethyl (E)-3-[4-(2-chlorophenoxy)-3-nitro-phenyl]-2-cyano-prop-2-enoate CAS Name: (E)-3-[4-(2-chlorophenoxy)-3-nitrophenyl]-2-cyano-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-3-[4-(2-chlorophenoxy)-3-nitrophenyl]-2-cyanoprop-2-enoate Traditional Name: (E)-3-[4-(2-chlorophenoxy)-3-nitro-phenyl]-2-cyano-acrylic acid ethyl ester Formula: C18H13ClN2O5 MolecularWeight: 372.75922

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CC1=CC(=C(C=C1)OC2=CC=CC=C2Cl)[N+](=O)[O-])C#N

Isomeric SMILES

CCOC(=O)/C(=C/C1=CC(=C(C=C1)OC2=CC=CC=C2Cl)[N+](=O)[O-])/C#N

InChI

InChI=1S/C18H13ClN2O5/c1-2-25-18(22)13(11-20)9-12-7-8-17(15(10-12)21(23)24)26-16-6-4-3-5-14(16)19/h3-10H,2H2,1H3/b13-9+