methyl 3-[[3-[2-bromanylethanoyl-[(4-hydroxyphenyl)methyl]amino]phenyl]amino]-3-oxidanylidene-propanoate

Systemtic Name: methyl 3-[[3-[2-bromanylethanoyl-[(4-hydroxyphenyl)methyl]amino]phenyl]amino]-3-oxidanylidene-propanoate Openeye Name: methyl 3-[3-[(2-bromoacetyl)-[(4-hydroxyphenyl)methyl]amino]anilino]-3-oxo-propanoate CAS Name: 3-[3-[(2-bromo-1-oxoethyl)-[(4-hydroxyphenyl)methyl]amino]anilino]-3-oxopropanoic acid methyl ester IUPAC Name: methyl 3-[3-[(2-bromoacetyl)-[(4-hydroxyphenyl)methyl]amino]anilino]-3-oxopropanoate Traditional Name: 3-[3-[(2-bromoacetyl)-(4-hydroxybenzyl)amino]anilino]-3-keto-propionic acid methyl ester Formula: C19H19BrN2O5 MolecularWeight: 435.26856

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(=O)NC1=CC(=CC=C1)N(CC2=CC=C(C=C2)O)C(=O)CBr

Isomeric SMILES

COC(=O)CC(=O)NC1=CC(=CC=C1)N(CC2=CC=C(C=C2)O)C(=O)CBr

InChI

InChI=1S/C19H19BrN2O5/c1-27-19(26)10-17(24)21-14-3-2-4-15(9-14)22(18(25)11-20)12-13-5-7-16(23)8-6-13/h2-9,23H,10-12H2,1H3,(H,21,24)