propan-2-yl 4-[[(E)-3-(5-bromanyl-2-methoxy-phenyl)prop-2-enoyl]amino]benzoate

Systemtic Name: propan-2-yl 4-[[(E)-3-(5-bromanyl-2-methoxy-phenyl)prop-2-enoyl]amino]benzoate Openeye Name: isopropyl 4-[[(E)-3-(5-bromo-2-methoxy-phenyl)prop-2-enoyl]amino]benzoate CAS Name: 4-[[(E)-3-(5-bromo-2-methoxyphenyl)-1-oxoprop-2-enyl]amino]benzoic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-[[(E)-3-(5-bromo-2-methoxyphenyl)prop-2-enoyl]amino]benzoate Traditional Name: 4-[[(E)-3-(5-bromo-2-methoxy-phenyl)acryloyl]amino]benzoic acid isopropyl ester Formula: C20H20BrNO4 MolecularWeight: 418.2811

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H20BrNO4/c1-13(2)26-20(24)14-4-8-17(9-5-14)22-19(23)11-6-15-12-16(21)7-10-18(15)25-3/h4-13H,1-3H3,(H,22,23)/b11-6+