3-(3-bromanyl-4-phenylmethoxy-phenyl)-2-cyano-N-(2,6-dimethylphenyl)prop-2-enamide

Systemtic Name: 3-(3-bromanyl-4-phenylmethoxy-phenyl)-2-cyano-N-(2,6-dimethylphenyl)prop-2-enamide Openeye Name: 3-(4-benzyloxy-3-bromo-phenyl)-2-cyano-N-(2,6-dimethylphenyl)prop-2-enamide CAS Name: 3-(3-bromo-4-phenylmethoxyphenyl)-2-cyano-N-(2,6-dimethylphenyl)-2-propenamide IUPAC Name: 3-(3-bromo-4-phenylmethoxyphenyl)-2-cyano-N-(2,6-dimethylphenyl)prop-2-enamide Traditional Name: 3-(4-benzoxy-3-bromo-phenyl)-2-cyano-N-(2,6-dimethylphenyl)acrylamide Formula: C25H21BrN2O2 MolecularWeight: 461.35044

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)C(=CC2=CC(=C(C=C2)OCC3=CC=CC=C3)Br)C#N

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)C(=CC2=CC(=C(C=C2)OCC3=CC=CC=C3)Br)C#N

InChI

InChI=1S/C25H21BrN2O2/c1-17-7-6-8-18(2)24(17)28-25(29)21(15-27)13-20-11-12-23(22(26)14-20)30-16-19-9-4-3-5-10-19/h3-14H,16H2,1-2H3,(H,28,29)