(5-bromanyl-3-methyl-1H-indol-2-yl)-(4-ethylpiperazin-4-ium-1-yl)methanone

Systemtic Name: (5-bromanyl-3-methyl-1H-indol-2-yl)-(4-ethylpiperazin-4-ium-1-yl)methanone Openeye Name: (5-bromo-3-methyl-1H-indol-2-yl)-(4-ethylpiperazin-4-ium-1-yl)methanone CAS Name: (5-bromo-3-methyl-1H-indol-2-yl)-(4-ethyl-1-piperazin-4-iumyl)methanone IUPAC Name: (5-bromo-3-methyl-1H-indol-2-yl)-(4-ethylpiperazin-4-ium-1-yl)methanone Traditional Name: (5-bromo-3-methyl-1H-indol-2-yl)-(4-ethylpiperazin-4-ium-1-yl)methanone Formula: C16H21BrN3O+ MolecularWeight: 351.26144

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C(=O)C2=C(C3=C(N2)C=CC(=C3)Br)C

Isomeric SMILES

CC[NH+]1CCN(CC1)C(=O)C2=C(C3=C(N2)C=CC(=C3)Br)C

InChI

InChI=1S/C16H20BrN3O/c1-3-19-6-8-20(9-7-19)16(21)15-11(2)13-10-12(17)4-5-14(13)18-15/h4-5,10,18H,3,6-9H2,1-2H3/p+1