(Z)-3-[3-chloranyl-5-ethoxy-4-(3-phenylpropoxy)phenyl]-2-cyano-prop-2-enoate

Systemtic Name: (Z)-3-[3-chloranyl-5-ethoxy-4-(3-phenylpropoxy)phenyl]-2-cyano-prop-2-enoate Openeye Name: (Z)-3-[3-chloro-5-ethoxy-4-(3-phenylpropoxy)phenyl]-2-cyano-prop-2-enoate CAS Name: (Z)-3-[3-chloro-5-ethoxy-4-(3-phenylpropoxy)phenyl]-2-cyano-2-propenoate IUPAC Name: (Z)-3-[3-chloro-5-ethoxy-4-(3-phenylpropoxy)phenyl]-2-cyanoprop-2-enoate Traditional Name: (Z)-3-[3-chloro-5-ethoxy-4-(3-phenylpropoxy)phenyl]-2-cyano-acrylate Formula: C21H19ClNO4- MolecularWeight: 384.83286

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C=C(C#N)C(=O)[O-])Cl)OCCCC2=CC=CC=C2

Isomeric SMILES

CCOC1=C(C(=CC(=C1)/C=C(/C#N)\C(=O)[O-])Cl)OCCCC2=CC=CC=C2

InChI

InChI=1S/C21H20ClNO4/c1-2-26-19-13-16(11-17(14-23)21(24)25)12-18(22)20(19)27-10-6-9-15-7-4-3-5-8-15/h3-5,7-8,11-13H,2,6,9-10H2,1H3,(H,24,25)/p-1/b17-11-