[1-(6-ethyl-1,4-dihydropyridin-3-yl)-4-methyl-piperazin-1-ium-1-yl]-indeno[1,2-c]pyrazol-3-yl-methanone

Systemtic Name: [1-(6-ethyl-1,4-dihydropyridin-3-yl)-4-methyl-piperazin-1-ium-1-yl]-indeno[1,2-c]pyrazol-3-yl-methanone Openeye Name: [1-(6-ethyl-1,4-dihydropyridin-3-yl)-4-methyl-piperazin-1-ium-1-yl]-indeno[1,2-c]pyrazol-3-yl-methanone CAS Name: [1-(6-ethyl-1,4-dihydropyridin-3-yl)-4-methyl-1-piperazin-1-iumyl]-(3-indeno[1,2-c]pyrazolyl)methanone IUPAC Name: [1-(6-ethyl-1,4-dihydropyridin-3-yl)-4-methylpiperazin-1-ium-1-yl]-indeno[1,2-c]pyrazol-3-ylmethanone Traditional Name: [1-(6-ethyl-1,4-dihydropyridin-3-yl)-4-methyl-piperazin-1-ium-1-yl]-indeno[1,2-c]pyrazol-3-yl-methanone Formula: C23H26N5O+ MolecularWeight: 388.48544

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CCC(=CN1)[N+]2(CCN(CC2)C)C(=O)C3=C4C=C5C=CC=CC5=C4N=N3

Isomeric SMILES

CCC1=CCC(=CN1)[N+]2(CCN(CC2)C)C(=O)C3=C4C=C5C=CC=CC5=C4N=N3

InChI

InChI=1S/C23H26N5O/c1-3-17-8-9-18(15-24-17)28(12-10-27(2)11-13-28)23(29)22-20-14-16-6-4-5-7-19(16)21(20)25-26-22/h4-8,14-15,24H,3,9-13H2,1-2H3/q+1