2-ethoxyethyl 4-[3-(3-bromanyl-4-methoxy-phenyl)prop-2-enoylamino]benzoate

Systemtic Name: 2-ethoxyethyl 4-[3-(3-bromanyl-4-methoxy-phenyl)prop-2-enoylamino]benzoate Openeye Name: 2-ethoxyethyl 4-[3-(3-bromo-4-methoxy-phenyl)prop-2-enoylamino]benzoate CAS Name: 4-[[3-(3-bromo-4-methoxyphenyl)-1-oxoprop-2-enyl]amino]benzoic acid 2-ethoxyethyl ester IUPAC Name: 2-ethoxyethyl 4-[3-(3-bromo-4-methoxyphenyl)prop-2-enoylamino]benzoate Traditional Name: 4-[[3-(3-bromo-4-methoxy-phenyl)acryloyl]amino]benzoic acid 2-ethoxyethyl ester Formula: C21H22BrNO5 MolecularWeight: 448.30708

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H22BrNO5/c1-3-27-12-13-28-21(25)16-6-8-17(9-7-16)23-20(24)11-5-15-4-10-19(26-2)18(22)14-15/h4-11,14H,3,12-13H2,1-2H3,(H,23,24)