methyl 3-bromanyl-4-[2-[(2-cyano-3-methyl-butan-2-yl)amino]-2-oxidanylidene-ethoxy]benzoate

Systemtic Name: methyl 3-bromanyl-4-[2-[(2-cyano-3-methyl-butan-2-yl)amino]-2-oxidanylidene-ethoxy]benzoate Openeye Name: methyl 3-bromo-4-[2-[(1-cyano-1,2-dimethyl-propyl)amino]-2-oxo-ethoxy]benzoate CAS Name: 3-bromo-4-[2-[(2-cyano-3-methylbutan-2-yl)amino]-2-oxoethoxy]benzoic acid methyl ester IUPAC Name: methyl 3-bromo-4-[2-[(2-cyano-3-methylbutan-2-yl)amino]-2-oxoethoxy]benzoate Traditional Name: 3-bromo-4-[2-[(1-cyano-1,2-dimethyl-propyl)amino]-2-keto-ethoxy]benzoic acid methyl ester Formula: C16H19BrN2O4 MolecularWeight: 383.23706

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C)(C#N)NC(=O)COC1=C(C=C(C=C1)C(=O)OC)Br

Isomeric SMILES

CC(C)C(C)(C#N)NC(=O)COC1=C(C=C(C=C1)C(=O)OC)Br

InChI

InChI=1S/C16H19BrN2O4/c1-10(2)16(3,9-18)19-14(20)8-23-13-6-5-11(7-12(13)17)15(21)22-4/h5-7,10H,8H2,1-4H3,(H,19,20)