methyl 2-bromanyl-4-[[1-(2-hydroxyphenyl)ethylamino]methyl]benzoate

Systemtic Name: methyl 2-bromanyl-4-[[1-(2-hydroxyphenyl)ethylamino]methyl]benzoate Openeye Name: methyl 2-bromo-4-[[1-(2-hydroxyphenyl)ethylamino]methyl]benzoate CAS Name: 2-bromo-4-[[1-(2-hydroxyphenyl)ethylamino]methyl]benzoic acid methyl ester IUPAC Name: methyl 2-bromo-4-[[1-(2-hydroxyphenyl)ethylamino]methyl]benzoate Traditional Name: 2-bromo-4-[[1-(2-hydroxyphenyl)ethylamino]methyl]benzoic acid methyl ester Formula: C17H18BrNO3 MolecularWeight: 364.23372

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1O)NCC2=CC(=C(C=C2)C(=O)OC)Br

Isomeric SMILES

CC(C1=CC=CC=C1O)NCC2=CC(=C(C=C2)C(=O)OC)Br

InChI

InChI=1S/C17H18BrNO3/c1-11(13-5-3-4-6-16(13)20)19-10-12-7-8-14(15(18)9-12)17(21)22-2/h3-9,11,19-20H,10H2,1-2H3