methyl 3-bromanyl-4-[2-[[1-(4-methoxyphenyl)-2-methyl-propyl]amino]-2-oxidanylidene-ethoxy]benzoate

Systemtic Name: methyl 3-bromanyl-4-[2-[[1-(4-methoxyphenyl)-2-methyl-propyl]amino]-2-oxidanylidene-ethoxy]benzoate Openeye Name: methyl 3-bromo-4-[2-[[1-(4-methoxyphenyl)-2-methyl-propyl]amino]-2-oxo-ethoxy]benzoate CAS Name: 3-bromo-4-[2-[[1-(4-methoxyphenyl)-2-methylpropyl]amino]-2-oxoethoxy]benzoic acid methyl ester IUPAC Name: methyl 3-bromo-4-[2-[[1-(4-methoxyphenyl)-2-methylpropyl]amino]-2-oxoethoxy]benzoate Traditional Name: 3-bromo-4-[2-keto-2-[[1-(4-methoxyphenyl)-2-methyl-propyl]amino]ethoxy]benzoic acid methyl ester Formula: C21H24BrNO5 MolecularWeight: 450.32296

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C1=CC=C(C=C1)OC)NC(=O)COC2=C(C=C(C=C2)C(=O)OC)Br

Isomeric SMILES

CC(C)C(C1=CC=C(C=C1)OC)NC(=O)COC2=C(C=C(C=C2)C(=O)OC)Br

InChI

InChI=1S/C21H24BrNO5/c1-13(2)20(14-5-8-16(26-3)9-6-14)23-19(24)12-28-18-10-7-15(11-17(18)22)21(25)27-4/h5-11,13,20H,12H2,1-4H3,(H,23,24)