ethyl 6-bromanyl-1-cyclohexyl-4-(dimethylaminomethyl)-5-oxidanyl-2-(pyrrolidin-1-ylmethyl)indole-3-carboxylate

Systemtic Name: ethyl 6-bromanyl-1-cyclohexyl-4-(dimethylaminomethyl)-5-oxidanyl-2-(pyrrolidin-1-ylmethyl)indole-3-carboxylate Openeye Name: ethyl 6-bromo-1-cyclohexyl-4-(dimethylaminomethyl)-5-hydroxy-2-(pyrrolidin-1-ylmethyl)indole-3-carboxylate CAS Name: 6-bromo-1-cyclohexyl-4-(dimethylaminomethyl)-5-hydroxy-2-(1-pyrrolidinylmethyl)-3-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 6-bromo-1-cyclohexyl-4-(dimethylaminomethyl)-5-hydroxy-2-(pyrrolidin-1-ylmethyl)indole-3-carboxylate Traditional Name: 6-bromo-1-cyclohexyl-4-(dimethylaminomethyl)-5-hydroxy-2-(pyrrolidinomethyl)indole-3-carboxylic acid ethyl ester Formula: C25H36BrN3O3 MolecularWeight: 506.47564

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C2=CC(=C(C(=C21)CN(C)C)O)Br)C3CCCCC3)CN4CCCC4

Isomeric SMILES

CCOC(=O)C1=C(N(C2=CC(=C(C(=C21)CN(C)C)O)Br)C3CCCCC3)CN4CCCC4

InChI

InChI=1S/C25H36BrN3O3/c1-4-32-25(31)23-21(16-28-12-8-9-13-28)29(17-10-6-5-7-11-17)20-14-19(26)24(30)18(22(20)23)15-27(2)3/h14,17,30H,4-13,15-16H2,1-3H3