N-[4-[(E)-3-(5-bromanyl-2-methoxy-phenyl)prop-2-enoyl]phenyl]-2,2-dimethyl-propanamide

Systemtic Name: N-[4-[(E)-3-(5-bromanyl-2-methoxy-phenyl)prop-2-enoyl]phenyl]-2,2-dimethyl-propanamide Openeye Name: N-[4-[(E)-3-(5-bromo-2-methoxy-phenyl)prop-2-enoyl]phenyl]-2,2-dimethyl-propanamide CAS Name: N-[4-[(E)-3-(5-bromo-2-methoxyphenyl)-1-oxoprop-2-enyl]phenyl]-2,2-dimethylpropanamide IUPAC Name: N-[4-[(E)-3-(5-bromo-2-methoxyphenyl)prop-2-enoyl]phenyl]-2,2-dimethylpropanamide Traditional Name: N-[4-[(E)-3-(5-bromo-2-methoxy-phenyl)acryloyl]phenyl]-2,2-dimethyl-propionamide Formula: C21H22BrNO3 MolecularWeight: 416.30828

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)NC1=CC=C(C=C1)C(=O)C=CC2=C(C=CC(=C2)Br)OC

Isomeric SMILES

CC(C)(C)C(=O)NC1=CC=C(C=C1)C(=O)/C=C/C2=C(C=CC(=C2)Br)OC

InChI

InChI=1S/C21H22BrNO3/c1-21(2,3)20(25)23-17-9-5-14(6-10-17)18(24)11-7-15-13-16(22)8-12-19(15)26-4/h5-13H,1-4H3,(H,23,25)/b11-7+