(2,6-ditert-butyl-4-methyl-cyclohexyl) 2-acetamido-5-chloranyl-4-(4-chlorophenyl)-1-methyl-pyrrole-3-carboxylate

Systemtic Name: (2,6-ditert-butyl-4-methyl-cyclohexyl) 2-acetamido-5-chloranyl-4-(4-chlorophenyl)-1-methyl-pyrrole-3-carboxylate Openeye Name: (2,6-ditert-butyl-4-methyl-cyclohexyl) 2-acetamido-5-chloro-4-(4-chlorophenyl)-1-methyl-pyrrole-3-carboxylate CAS Name: 2-acetamido-5-chloro-4-(4-chlorophenyl)-1-methyl-3-pyrrolecarboxylic acid (2,6-ditert-butyl-4-methylcyclohexyl) ester IUPAC Name: (2,6-ditert-butyl-4-methylcyclohexyl) 2-acetamido-5-chloro-4-(4-chlorophenyl)-1-methylpyrrole-3-carboxylate Traditional Name: 2-acetamido-5-chloro-4-(4-chlorophenyl)-1-methyl-pyrrole-3-carboxylic acid (2,6-ditert-butyl-4-methyl-cyclohexyl) ester Formula: C29H40Cl2N2O3 MolecularWeight: 535.5455

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(C(C(C1)C(C)(C)C)OC(=O)C2=C(N(C(=C2C3=CC=C(C=C3)Cl)Cl)C)NC(=O)C)C(C)(C)C

Isomeric SMILES

CC1CC(C(C(C1)C(C)(C)C)OC(=O)C2=C(N(C(=C2C3=CC=C(C=C3)Cl)Cl)C)NC(=O)C)C(C)(C)C

InChI

InChI=1S/C29H40Cl2N2O3/c1-16-14-20(28(3,4)5)24(21(15-16)29(6,7)8)36-27(35)23-22(18-10-12-19(30)13-11-18)25(31)33(9)26(23)32-17(2)34/h10-13,16,20-21,24H,14-15H2,1-9H3,(H,32,34)