methyl 3-bromanyl-4-[2-[(1-ethylpiperidin-4-yl)amino]-2-oxidanylidene-ethoxy]benzoate

Systemtic Name: methyl 3-bromanyl-4-[2-[(1-ethylpiperidin-4-yl)amino]-2-oxidanylidene-ethoxy]benzoate Openeye Name: methyl 3-bromo-4-[2-[(1-ethyl-4-piperidyl)amino]-2-oxo-ethoxy]benzoate CAS Name: 3-bromo-4-[2-[(1-ethyl-4-piperidinyl)amino]-2-oxoethoxy]benzoic acid methyl ester IUPAC Name: methyl 3-bromo-4-[2-[(1-ethylpiperidin-4-yl)amino]-2-oxoethoxy]benzoate Traditional Name: 3-bromo-4-[2-[(1-ethyl-4-piperidyl)amino]-2-keto-ethoxy]benzoic acid methyl ester Formula: C17H23BrN2O4 MolecularWeight: 399.27952

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCC(CC1)NC(=O)COC2=C(C=C(C=C2)C(=O)OC)Br

Isomeric SMILES

CCN1CCC(CC1)NC(=O)COC2=C(C=C(C=C2)C(=O)OC)Br

InChI

InChI=1S/C17H23BrN2O4/c1-3-20-8-6-13(7-9-20)19-16(21)11-24-15-5-4-12(10-14(15)18)17(22)23-2/h4-5,10,13H,3,6-9,11H2,1-2H3,(H,19,21)