2-[4-[2-(2-methylindol-1-yl)ethanoyl]piperazin-1-ium-1-yl]-1-pyrrolidin-1-yl-ethanone

Systemtic Name: 2-[4-[2-(2-methylindol-1-yl)ethanoyl]piperazin-1-ium-1-yl]-1-pyrrolidin-1-yl-ethanone Openeye Name: 2-[4-[2-(2-methylindol-1-yl)acetyl]piperazin-1-ium-1-yl]-1-pyrrolidin-1-yl-ethanone CAS Name: 2-[4-[2-(2-methyl-1-indolyl)-1-oxoethyl]-1-piperazin-1-iumyl]-1-(1-pyrrolidinyl)ethanone IUPAC Name: 2-[4-[2-(2-methylindol-1-yl)acetyl]piperazin-1-ium-1-yl]-1-pyrrolidin-1-ylethanone Traditional Name: 2-[4-[2-(2-methylindol-1-yl)acetyl]piperazin-1-ium-1-yl]-1-pyrrolidino-ethanone Formula: C21H29N4O2+ MolecularWeight: 369.48056

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=CC=CC=C2N1CC(=O)N3CC[NH+](CC3)CC(=O)N4CCCC4

Isomeric SMILES

CC1=CC2=CC=CC=C2N1CC(=O)N3CC[NH+](CC3)CC(=O)N4CCCC4

InChI

InChI=1S/C21H28N4O2/c1-17-14-18-6-2-3-7-19(18)25(17)16-21(27)24-12-10-22(11-13-24)15-20(26)23-8-4-5-9-23/h2-3,6-7,14H,4-5,8-13,15-16H2,1H3/p+1