ethyl 6-bromanyl-1-(3-chlorophenyl)-2-methyl-5-oxidanyl-4-(piperidin-1-ylmethyl)indole-3-carboxylate

Systemtic Name: ethyl 6-bromanyl-1-(3-chlorophenyl)-2-methyl-5-oxidanyl-4-(piperidin-1-ylmethyl)indole-3-carboxylate Openeye Name: ethyl 6-bromo-1-(3-chlorophenyl)-5-hydroxy-2-methyl-4-(1-piperidylmethyl)indole-3-carboxylate CAS Name: 6-bromo-1-(3-chlorophenyl)-5-hydroxy-2-methyl-4-(1-piperidinylmethyl)-3-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 6-bromo-1-(3-chlorophenyl)-5-hydroxy-2-methyl-4-(piperidin-1-ylmethyl)indole-3-carboxylate Traditional Name: 6-bromo-1-(3-chlorophenyl)-5-hydroxy-2-methyl-4-(piperidinomethyl)indole-3-carboxylic acid ethyl ester Formula: C24H26BrClN2O3 MolecularWeight: 505.83184

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C2=CC(=C(C(=C21)CN3CCCCC3)O)Br)C4=CC(=CC=C4)Cl)C

Isomeric SMILES

CCOC(=O)C1=C(N(C2=CC(=C(C(=C21)CN3CCCCC3)O)Br)C4=CC(=CC=C4)Cl)C

InChI

InChI=1S/C24H26BrClN2O3/c1-3-31-24(30)21-15(2)28(17-9-7-8-16(26)12-17)20-13-19(25)23(29)18(22(20)21)14-27-10-5-4-6-11-27/h7-9,12-13,29H,3-6,10-11,14H2,1-2H3