methyl 1-[3-(2-bromophenyl)propyl]-3-cyclohexyl-indole-6-carboxylate

Systemtic Name: methyl 1-[3-(2-bromophenyl)propyl]-3-cyclohexyl-indole-6-carboxylate Openeye Name: methyl 1-[3-(2-bromophenyl)propyl]-3-cyclohexyl-indole-6-carboxylate CAS Name: 1-[3-(2-bromophenyl)propyl]-3-cyclohexyl-6-indolecarboxylic acid methyl ester IUPAC Name: methyl 1-[3-(2-bromophenyl)propyl]-3-cyclohexylindole-6-carboxylate Traditional Name: 1-[3-(2-bromophenyl)propyl]-3-cyclohexyl-indole-6-carboxylic acid methyl ester Formula: C25H28BrNO2 MolecularWeight: 454.39932

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)C(=CN2CCCC3=CC=CC=C3Br)C4CCCCC4

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)C(=CN2CCCC3=CC=CC=C3Br)C4CCCCC4

InChI

InChI=1S/C25H28BrNO2/c1-29-25(28)20-13-14-21-22(18-8-3-2-4-9-18)17-27(24(21)16-20)15-7-11-19-10-5-6-12-23(19)26/h5-6,10,12-14,16-18H,2-4,7-9,11,15H2,1H3