O1-tert-butyl O6-methyl 2-bromanyl-3-cyclohexyl-indole-1,6-dicarboxylate

Systemtic Name: O1-tert-butyl O6-methyl 2-bromanyl-3-cyclohexyl-indole-1,6-dicarboxylate Openeye Name: O1-tert-butyl O6-methyl 2-bromo-3-cyclohexyl-indole-1,6-dicarboxylate CAS Name: 2-bromo-3-cyclohexylindole-1,6-dicarboxylic acid O1-tert-butyl ester O6-methyl ester IUPAC Name: 1-O-tert-butyl 6-O-methyl 2-bromo-3-cyclohexylindole-1,6-dicarboxylate Traditional Name: 2-bromo-3-cyclohexyl-indole-1,6-dicarboxylic acid O1-tert-butyl ester O6-methyl ester Formula: C21H26BrNO4 MolecularWeight: 436.33944

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C2=C(C=CC(=C2)C(=O)OC)C(=C1Br)C3CCCCC3

Isomeric SMILES

CC(C)(C)OC(=O)N1C2=C(C=CC(=C2)C(=O)OC)C(=C1Br)C3CCCCC3

InChI

InChI=1S/C21H26BrNO4/c1-21(2,3)27-20(25)23-16-12-14(19(24)26-4)10-11-15(16)17(18(23)22)13-8-6-5-7-9-13/h10-13H,5-9H2,1-4H3