3-(5-bromanyl-2-methoxy-phenyl)-N-[1-(2-phenylmethoxyethyl)pyrazol-4-yl]prop-2-enamide

Systemtic Name: 3-(5-bromanyl-2-methoxy-phenyl)-N-[1-(2-phenylmethoxyethyl)pyrazol-4-yl]prop-2-enamide Openeye Name: N-[1-(2-benzyloxyethyl)pyrazol-4-yl]-3-(5-bromo-2-methoxy-phenyl)prop-2-enamide CAS Name: 3-(5-bromo-2-methoxyphenyl)-N-[1-(2-phenylmethoxyethyl)-4-pyrazolyl]-2-propenamide IUPAC Name: 3-(5-bromo-2-methoxyphenyl)-N-[1-(2-phenylmethoxyethyl)pyrazol-4-yl]prop-2-enamide Traditional Name: N-[1-(2-benzoxyethyl)pyrazol-4-yl]-3-(5-bromo-2-methoxy-phenyl)acrylamide Formula: C22H22BrN3O3 MolecularWeight: 456.33238

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)C=CC(=O)NC2=CN(N=C2)CCOCC3=CC=CC=C3

Isomeric SMILES

COC1=C(C=C(C=C1)Br)C=CC(=O)NC2=CN(N=C2)CCOCC3=CC=CC=C3

InChI

InChI=1S/C22H22BrN3O3/c1-28-21-9-8-19(23)13-18(21)7-10-22(27)25-20-14-24-26(15-20)11-12-29-16-17-5-3-2-4-6-17/h2-10,13-15H,11-12,16H2,1H3,(H,25,27)