3-bromanyl-N-[2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-1H-indole-2-carboxamide

Systemtic Name: 3-bromanyl-N-[2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-1H-indole-2-carboxamide Openeye Name: 3-bromo-N-[2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-1H-indole-2-carboxamide CAS Name: 3-bromo-N-[2-(4-ethyl-1-piperazin-4-iumyl)phenyl]-1H-indole-2-carboxamide IUPAC Name: 3-bromo-N-[2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-1H-indole-2-carboxamide Traditional Name: 3-bromo-N-[2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-1H-indole-2-carboxamide Formula: C21H24BrN4O+ MolecularWeight: 428.34546

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=CC=CC=C2NC(=O)C3=C(C4=CC=CC=C4N3)Br

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=CC=CC=C2NC(=O)C3=C(C4=CC=CC=C4N3)Br

InChI

InChI=1S/C21H23BrN4O/c1-2-25-11-13-26(14-12-25)18-10-6-5-9-17(18)24-21(27)20-19(22)15-7-3-4-8-16(15)23-20/h3-10,23H,2,11-14H2,1H3,(H,24,27)/p+1