O1-[2-[(4-bromanyl-5-chloranyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl] O2-(5-methyl-2-propan-2-yl-cyclohexyl) benzene-1,2-dicarboxylate

Systemtic Name: O1-[2-[(4-bromanyl-5-chloranyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl] O2-(5-methyl-2-propan-2-yl-cyclohexyl) benzene-1,2-dicarboxylate Openeye Name: O1-[2-(4-bromo-5-chloro-2-methyl-anilino)-2-oxo-ethyl] O2-(2-isopropyl-5-methyl-cyclohexyl) benzene-1,2-dicarboxylate CAS Name: benzene-1,2-dicarboxylic acid O1-[2-(4-bromo-5-chloro-2-methylanilino)-2-oxoethyl] ester O2-(5-methyl-2-propan-2-ylcyclohexyl) ester IUPAC Name: 1-O-[2-(4-bromo-5-chloro-2-methylanilino)-2-oxoethyl] 2-O-(5-methyl-2-propan-2-ylcyclohexyl) benzene-1,2-dicarboxylate Traditional Name: benzene-1,2-dicarboxylic acid O1-[2-(4-bromo-5-chloro-2-methyl-anilino)-2-keto-ethyl] ester O2-(2-isopropyl-5-methyl-cyclohexyl) ester Formula: C27H31BrClNO5 MolecularWeight: 564.89574

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(C1)OC(=O)C2=CC=CC=C2C(=O)OCC(=O)NC3=CC(=C(C=C3C)Br)Cl)C(C)C

Isomeric SMILES

CC1CCC(C(C1)OC(=O)C2=CC=CC=C2C(=O)OCC(=O)NC3=CC(=C(C=C3C)Br)Cl)C(C)C

InChI

InChI=1S/C27H31BrClNO5/c1-15(2)18-10-9-16(3)11-24(18)35-27(33)20-8-6-5-7-19(20)26(32)34-14-25(31)30-23-13-22(29)21(28)12-17(23)4/h5-8,12-13,15-16,18,24H,9-11,14H2,1-4H3,(H,30,31)