(2-bromanyl-4-cyano-6-ethoxy-phenyl) 3-(4-dimethylaminophenyl)propanoate

Systemtic Name: (2-bromanyl-4-cyano-6-ethoxy-phenyl) 3-(4-dimethylaminophenyl)propanoate Openeye Name: (2-bromo-4-cyano-6-ethoxy-phenyl) 3-(4-dimethylaminophenyl)propanoate CAS Name: 3-(4-dimethylaminophenyl)propanoic acid (2-bromo-4-cyano-6-ethoxyphenyl) ester IUPAC Name: (2-bromo-4-cyano-6-ethoxyphenyl) 3-(4-dimethylaminophenyl)propanoate Traditional Name: 3-(4-dimethylaminophenyl)propionic acid (2-bromo-4-cyano-6-ethoxy-phenyl) ester Formula: C20H21BrN2O3 MolecularWeight: 417.29634

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C#N)Br)OC(=O)CCC2=CC=C(C=C2)N(C)C

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C#N)Br)OC(=O)CCC2=CC=C(C=C2)N(C)C

InChI

InChI=1S/C20H21BrN2O3/c1-4-25-18-12-15(13-22)11-17(21)20(18)26-19(24)10-7-14-5-8-16(9-6-14)23(2)3/h5-6,8-9,11-12H,4,7,10H2,1-3H3