(E)-3-(1H-indol-3-yl)-1-(4-methylpiperazin-4-ium-1-yl)prop-2-en-1-one

Systemtic Name: (E)-3-(1H-indol-3-yl)-1-(4-methylpiperazin-4-ium-1-yl)prop-2-en-1-one Openeye Name: (E)-3-(1H-indol-3-yl)-1-(4-methylpiperazin-4-ium-1-yl)prop-2-en-1-one CAS Name: (E)-3-(1H-indol-3-yl)-1-(4-methyl-1-piperazin-4-iumyl)-2-propen-1-one IUPAC Name: (E)-3-(1H-indol-3-yl)-1-(4-methylpiperazin-4-ium-1-yl)prop-2-en-1-one Traditional Name: (E)-3-(1H-indol-3-yl)-1-(4-methylpiperazin-4-ium-1-yl)prop-2-en-1-one Formula: C16H20N3O+ MolecularWeight: 270.3495

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C(=O)C=CC2=CNC3=CC=CC=C32

Isomeric SMILES

C[NH+]1CCN(CC1)C(=O)/C=C/C2=CNC3=CC=CC=C32

InChI

InChI=1S/C16H19N3O/c1-18-8-10-19(11-9-18)16(20)7-6-13-12-17-15-5-3-2-4-14(13)15/h2-7,12,17H,8-11H2,1H3/p+1/b7-6+