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

Systemtic Name: propan-2-yl 4-[3-(3-bromanyl-4,5-dimethoxy-phenyl)prop-2-enoylamino]benzoate Openeye Name: isopropyl 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 propan-2-yl ester IUPAC Name: propan-2-yl 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 isopropyl ester Formula: C21H22BrNO5 MolecularWeight: 448.30708

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H22BrNO5/c1-13(2)28-21(25)15-6-8-16(9-7-15)23-19(24)10-5-14-11-17(22)20(27-4)18(12-14)26-3/h5-13H,1-4H3,(H,23,24)