N-cyclopropyl-2-[4-[2-(7-ethyl-1H-indol-3-yl)-2-oxidanylidene-ethyl]piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-cyclopropyl-2-[4-[2-(7-ethyl-1H-indol-3-yl)-2-oxidanylidene-ethyl]piperazin-1-ium-1-yl]ethanamide Openeye Name: N-cyclopropyl-2-[4-[2-(7-ethyl-1H-indol-3-yl)-2-oxo-ethyl]piperazin-1-ium-1-yl]acetamide CAS Name: N-cyclopropyl-2-[4-[2-(7-ethyl-1H-indol-3-yl)-2-oxoethyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-cyclopropyl-2-[4-[2-(7-ethyl-1H-indol-3-yl)-2-oxoethyl]piperazin-1-ium-1-yl]acetamide Traditional Name: N-cyclopropyl-2-[4-[2-(7-ethyl-1H-indol-3-yl)-2-keto-ethyl]piperazin-1-ium-1-yl]acetamide Formula: C21H29N4O2+ MolecularWeight: 369.48056

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC2=C1NC=C2C(=O)CN3CC[NH+](CC3)CC(=O)NC4CC4

Isomeric SMILES

CCC1=CC=CC2=C1NC=C2C(=O)CN3CC[NH+](CC3)CC(=O)NC4CC4

InChI

InChI=1S/C21H28N4O2/c1-2-15-4-3-5-17-18(12-22-21(15)17)19(26)13-24-8-10-25(11-9-24)14-20(27)23-16-6-7-16/h3-5,12,16,22H,2,6-11,13-14H2,1H3,(H,23,27)/p+1