2-[4-(6-methoxy-2-methyl-quinolin-3-yl)carbonylpiperazin-1-ium-1-yl]-1-piperidin-1-yl-ethanone

Systemtic Name: 2-[4-(6-methoxy-2-methyl-quinolin-3-yl)carbonylpiperazin-1-ium-1-yl]-1-piperidin-1-yl-ethanone Openeye Name: 2-[4-(6-methoxy-2-methyl-quinoline-3-carbonyl)piperazin-1-ium-1-yl]-1-(1-piperidyl)ethanone CAS Name: 2-[4-[(6-methoxy-2-methyl-3-quinolinyl)-oxomethyl]-1-piperazin-1-iumyl]-1-(1-piperidinyl)ethanone IUPAC Name: 2-[4-(6-methoxy-2-methylquinoline-3-carbonyl)piperazin-1-ium-1-yl]-1-piperidin-1-ylethanone Traditional Name: 2-[4-(6-methoxy-2-methyl-quinoline-3-carbonyl)piperazin-1-ium-1-yl]-1-piperidino-ethanone Formula: C23H31N4O3+ MolecularWeight: 411.51724

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C=C(C=CC2=N1)OC)C(=O)N3CC[NH+](CC3)CC(=O)N4CCCCC4

Isomeric SMILES

CC1=C(C=C2C=C(C=CC2=N1)OC)C(=O)N3CC[NH+](CC3)CC(=O)N4CCCCC4

InChI

InChI=1S/C23H30N4O3/c1-17-20(15-18-14-19(30-2)6-7-21(18)24-17)23(29)27-12-10-25(11-13-27)16-22(28)26-8-4-3-5-9-26/h6-7,14-15H,3-5,8-13,16H2,1-2H3/p+1