[2-[cyclohexyl(methyl)amino]-2-oxidanylidene-ethyl] 4-bromanylbenzoate

Systemtic Name: [2-[cyclohexyl(methyl)amino]-2-oxidanylidene-ethyl] 4-bromanylbenzoate Openeye Name: [2-[cyclohexyl(methyl)amino]-2-oxo-ethyl] 4-bromobenzoate CAS Name: 4-bromobenzoic acid [2-[cyclohexyl(methyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[cyclohexyl(methyl)amino]-2-oxoethyl] 4-bromobenzoate Traditional Name: 4-bromobenzoic acid [2-[cyclohexyl(methyl)amino]-2-keto-ethyl] ester Formula: C16H20BrNO3 MolecularWeight: 354.2389

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCCCC1)C(=O)COC(=O)C2=CC=C(C=C2)Br

Isomeric SMILES

CN(C1CCCCC1)C(=O)COC(=O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C16H20BrNO3/c1-18(14-5-3-2-4-6-14)15(19)11-21-16(20)12-7-9-13(17)10-8-12/h7-10,14H,2-6,11H2,1H3