ethyl 6-bromanyl-1-cyclohexyl-2-[(4-ethoxycarbonyl-4-phenyl-piperidin-1-yl)methyl]-5-oxidanyl-indole-3-carboxylate

Systemtic Name: ethyl 6-bromanyl-1-cyclohexyl-2-[(4-ethoxycarbonyl-4-phenyl-piperidin-1-yl)methyl]-5-oxidanyl-indole-3-carboxylate Openeye Name: ethyl 6-bromo-1-cyclohexyl-2-[(4-ethoxycarbonyl-4-phenyl-1-piperidyl)methyl]-5-hydroxy-indole-3-carboxylate CAS Name: 6-bromo-1-cyclohexyl-2-[(4-ethoxycarbonyl-4-phenyl-1-piperidinyl)methyl]-5-hydroxy-3-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 6-bromo-1-cyclohexyl-2-[(4-ethoxycarbonyl-4-phenylpiperidin-1-yl)methyl]-5-hydroxyindole-3-carboxylate Traditional Name: 6-bromo-2-[(4-carbethoxy-4-phenyl-piperidino)methyl]-1-cyclohexyl-5-hydroxy-indole-3-carboxylic acid ethyl ester Formula: C32H39BrN2O5 MolecularWeight: 611.56646

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C2=CC(=C(C=C21)O)Br)C3CCCCC3)CN4CCC(CC4)(C5=CC=CC=C5)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1=C(N(C2=CC(=C(C=C21)O)Br)C3CCCCC3)CN4CCC(CC4)(C5=CC=CC=C5)C(=O)OCC

InChI

InChI=1S/C32H39BrN2O5/c1-3-39-30(37)29-24-19-28(36)25(33)20-26(24)35(23-13-9-6-10-14-23)27(29)21-34-17-15-32(16-18-34,31(38)40-4-2)22-11-7-5-8-12-22/h5,7-8,11-12,19-20,23,36H,3-4,6,9-10,13-18,21H2,1-2H3