3-(3-bromanyl-4-butan-2-yloxy-5-methoxy-phenyl)-2-cyano-N-(4-hydroxyphenyl)prop-2-enamide

Systemtic Name: 3-(3-bromanyl-4-butan-2-yloxy-5-methoxy-phenyl)-2-cyano-N-(4-hydroxyphenyl)prop-2-enamide Openeye Name: 3-(3-bromo-5-methoxy-4-sec-butoxy-phenyl)-2-cyano-N-(4-hydroxyphenyl)prop-2-enamide CAS Name: 3-(3-bromo-4-butan-2-yloxy-5-methoxyphenyl)-2-cyano-N-(4-hydroxyphenyl)-2-propenamide IUPAC Name: 3-(3-bromo-4-butan-2-yloxy-5-methoxyphenyl)-2-cyano-N-(4-hydroxyphenyl)prop-2-enamide Traditional Name: 3-(3-bromo-5-methoxy-4-sec-butoxy-phenyl)-2-cyano-N-(4-hydroxyphenyl)acrylamide Formula: C21H21BrN2O4 MolecularWeight: 445.30644

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)OC1=C(C=C(C=C1Br)C=C(C#N)C(=O)NC2=CC=C(C=C2)O)OC

Isomeric SMILES

CCC(C)OC1=C(C=C(C=C1Br)C=C(C#N)C(=O)NC2=CC=C(C=C2)O)OC

InChI

InChI=1S/C21H21BrN2O4/c1-4-13(2)28-20-18(22)10-14(11-19(20)27-3)9-15(12-23)21(26)24-16-5-7-17(25)8-6-16/h5-11,13,25H,4H2,1-3H3,(H,24,26)