5-bromanyl-N-[(1-morpholin-4-ium-4-ylcyclohexyl)methyl]-1H-indole-2-carboxamide

Systemtic Name: 5-bromanyl-N-[(1-morpholin-4-ium-4-ylcyclohexyl)methyl]-1H-indole-2-carboxamide Openeye Name: 5-bromo-N-[(1-morpholin-4-ium-4-ylcyclohexyl)methyl]-1H-indole-2-carboxamide CAS Name: 5-bromo-N-[[1-(4-morpholin-4-iumyl)cyclohexyl]methyl]-1H-indole-2-carboxamide IUPAC Name: 5-bromo-N-[(1-morpholin-4-ium-4-ylcyclohexyl)methyl]-1H-indole-2-carboxamide Traditional Name: 5-bromo-N-[(1-morpholin-4-ium-4-ylcyclohexyl)methyl]-1H-indole-2-carboxamide Formula: C20H27BrN3O2+ MolecularWeight: 421.35128

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(CNC(=O)C2=CC3=C(N2)C=CC(=C3)Br)[NH+]4CCOCC4

Isomeric SMILES

C1CCC(CC1)(CNC(=O)C2=CC3=C(N2)C=CC(=C3)Br)[NH+]4CCOCC4

InChI

InChI=1S/C20H26BrN3O2/c21-16-4-5-17-15(12-16)13-18(23-17)19(25)22-14-20(6-2-1-3-7-20)24-8-10-26-11-9-24/h4-5,12-13,23H,1-3,6-11,14H2,(H,22,25)/p+1