[2-[[(1S,2S)-2-methylcyclohexyl]amino]-2-oxidanylidene-ethyl] 4-(4-bromophenyl)-4-oxidanylidene-butanoate

Systemtic Name: [2-[[(1S,2S)-2-methylcyclohexyl]amino]-2-oxidanylidene-ethyl] 4-(4-bromophenyl)-4-oxidanylidene-butanoate Openeye Name: [2-[[(1S,2S)-2-methylcyclohexyl]amino]-2-oxo-ethyl] 4-(4-bromophenyl)-4-oxo-butanoate CAS Name: 4-(4-bromophenyl)-4-oxobutanoic acid [2-[[(1S,2S)-2-methylcyclohexyl]amino]-2-oxoethyl] ester IUPAC Name: [2-[[(1S,2S)-2-methylcyclohexyl]amino]-2-oxoethyl] 4-(4-bromophenyl)-4-oxobutanoate Traditional Name: 4-(4-bromophenyl)-4-keto-butyric acid [2-keto-2-[[(1S,2S)-2-methylcyclohexyl]amino]ethyl] ester Formula: C19H24BrNO4 MolecularWeight: 410.30216

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1NC(=O)COC(=O)CCC(=O)C2=CC=C(C=C2)Br

Isomeric SMILES

C[C@H]1CCCC[C@@H]1NC(=O)COC(=O)CCC(=O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C19H24BrNO4/c1-13-4-2-3-5-16(13)21-18(23)12-25-19(24)11-10-17(22)14-6-8-15(20)9-7-14/h6-9,13,16H,2-5,10-12H2,1H3,(H,21,23)/t13-,16-/m0/s1