2-methylpropyl 4-[3-(3-bromanyl-4,5-dimethoxy-phenyl)prop-2-enoylamino]benzoate

Systemtic Name: 2-methylpropyl 4-[3-(3-bromanyl-4,5-dimethoxy-phenyl)prop-2-enoylamino]benzoate Openeye Name: isobutyl 4-[3-(3-bromo-4,5-dimethoxy-phenyl)prop-2-enoylamino]benzoate CAS Name: 4-[[3-(3-bromo-4,5-dimethoxyphenyl)-1-oxoprop-2-enyl]amino]benzoic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 4-[3-(3-bromo-4,5-dimethoxyphenyl)prop-2-enoylamino]benzoate Traditional Name: 4-[[3-(3-bromo-4,5-dimethoxy-phenyl)acryloyl]amino]benzoic acid isobutyl ester Formula: C22H24BrNO5 MolecularWeight: 462.33366

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC(=O)C1=CC=C(C=C1)NC(=O)C=CC2=CC(=C(C(=C2)Br)OC)OC

Isomeric SMILES

CC(C)COC(=O)C1=CC=C(C=C1)NC(=O)C=CC2=CC(=C(C(=C2)Br)OC)OC

InChI

InChI=1S/C22H24BrNO5/c1-14(2)13-29-22(26)16-6-8-17(9-7-16)24-20(25)10-5-15-11-18(23)21(28-4)19(12-15)27-3/h5-12,14H,13H2,1-4H3,(H,24,25)