methyl 2-bromanyl-4-[[(5-ethoxy-5-oxidanylidene-pentyl)-[2-(2-hydroxyphenyl)ethyl]amino]methyl]benzoate

Systemtic Name: methyl 2-bromanyl-4-[[(5-ethoxy-5-oxidanylidene-pentyl)-[2-(2-hydroxyphenyl)ethyl]amino]methyl]benzoate Openeye Name: methyl 2-bromo-4-[[(5-ethoxy-5-oxo-pentyl)-[2-(2-hydroxyphenyl)ethyl]amino]methyl]benzoate CAS Name: 2-bromo-4-[[(5-ethoxy-5-oxopentyl)-[2-(2-hydroxyphenyl)ethyl]amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 2-bromo-4-[[(5-ethoxy-5-oxopentyl)-[2-(2-hydroxyphenyl)ethyl]amino]methyl]benzoate Traditional Name: 2-bromo-4-[[(5-ethoxy-5-keto-pentyl)-[2-(2-hydroxyphenyl)ethyl]amino]methyl]benzoic acid methyl ester Formula: C24H30BrNO5 MolecularWeight: 492.4027

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCCN(CCC1=CC=CC=C1O)CC2=CC(=C(C=C2)C(=O)OC)Br

Isomeric SMILES

CCOC(=O)CCCCN(CCC1=CC=CC=C1O)CC2=CC(=C(C=C2)C(=O)OC)Br

InChI

InChI=1S/C24H30BrNO5/c1-3-31-23(28)10-6-7-14-26(15-13-19-8-4-5-9-22(19)27)17-18-11-12-20(21(25)16-18)24(29)30-2/h4-5,8-9,11-12,16,27H,3,6-7,10,13-15,17H2,1-2H3