[2-[(3-bromanyl-4-methyl-phenyl)amino]-2-oxidanylidene-ethyl] 4-tert-butylcyclohexane-1-carboxylate

Systemtic Name: [2-[(3-bromanyl-4-methyl-phenyl)amino]-2-oxidanylidene-ethyl] 4-tert-butylcyclohexane-1-carboxylate Openeye Name: [2-(3-bromo-4-methyl-anilino)-2-oxo-ethyl] 4-tert-butylcyclohexanecarboxylate CAS Name: 4-tert-butyl-1-cyclohexanecarboxylic acid [2-(3-bromo-4-methylanilino)-2-oxoethyl] ester IUPAC Name: [2-(3-bromo-4-methylanilino)-2-oxoethyl] 4-tert-butylcyclohexane-1-carboxylate Traditional Name: 4-tert-butylcyclohexanecarboxylic acid [2-(3-bromo-4-methyl-anilino)-2-keto-ethyl] ester Formula: C20H28BrNO3 MolecularWeight: 410.34522

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)COC(=O)C2CCC(CC2)C(C)(C)C)Br

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)COC(=O)C2CCC(CC2)C(C)(C)C)Br

InChI

InChI=1S/C20H28BrNO3/c1-13-5-10-16(11-17(13)21)22-18(23)12-25-19(24)14-6-8-15(9-7-14)20(2,3)4/h5,10-11,14-15H,6-9,12H2,1-4H3,(H,22,23)