(Z)-3-[3-bromanyl-4-(2-dimethylaminoethyloxy)-5-ethoxy-phenyl]-2-cyano-prop-2-enoic acid

Systemtic Name: (Z)-3-[3-bromanyl-4-(2-dimethylaminoethyloxy)-5-ethoxy-phenyl]-2-cyano-prop-2-enoic acid Openeye Name: (Z)-3-[3-bromo-4-(2-dimethylaminoethyloxy)-5-ethoxy-phenyl]-2-cyano-prop-2-enoic acid CAS Name: (Z)-3-[3-bromo-4-(2-dimethylaminoethyloxy)-5-ethoxyphenyl]-2-cyano-2-propenoic acid IUPAC Name: (Z)-3-[3-bromo-4-(2-dimethylaminoethyloxy)-5-ethoxyphenyl]-2-cyanoprop-2-enoic acid Traditional Name: (Z)-3-[3-bromo-4-(2-dimethylaminoethyloxy)-5-ethoxy-phenyl]-2-cyano-acrylic acid Formula: C16H19BrN2O4 MolecularWeight: 383.23706

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C=C(C#N)C(=O)O)Br)OCCN(C)C

Isomeric SMILES

CCOC1=C(C(=CC(=C1)/C=C(/C#N)\C(=O)O)Br)OCCN(C)C

InChI

InChI=1S/C16H19BrN2O4/c1-4-22-14-9-11(7-12(10-18)16(20)21)8-13(17)15(14)23-6-5-19(2)3/h7-9H,4-6H2,1-3H3,(H,20,21)/b12-7-