[4-[1-[(1,5-dimethylpyrazol-4-yl)methyl]piperidin-1-ium-4-yl]oxyphenyl]-piperidin-1-yl-methanone

Systemtic Name: [4-[1-[(1,5-dimethylpyrazol-4-yl)methyl]piperidin-1-ium-4-yl]oxyphenyl]-piperidin-1-yl-methanone Openeye Name: [4-[1-[(1,5-dimethylpyrazol-4-yl)methyl]piperidin-1-ium-4-yl]oxyphenyl]-(1-piperidyl)methanone CAS Name: [4-[[1-[(1,5-dimethyl-4-pyrazolyl)methyl]-4-piperidin-1-iumyl]oxy]phenyl]-(1-piperidinyl)methanone IUPAC Name: [4-[1-[(1,5-dimethylpyrazol-4-yl)methyl]piperidin-1-ium-4-yl]oxyphenyl]-piperidin-1-ylmethanone Traditional Name: [4-[1-[(1,5-dimethylpyrazol-4-yl)methyl]piperidin-1-ium-4-yl]oxyphenyl]-piperidino-methanone Formula: C23H33N4O2+ MolecularWeight: 397.53372

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C)C[NH+]2CCC(CC2)OC3=CC=C(C=C3)C(=O)N4CCCCC4

Isomeric SMILES

CC1=C(C=NN1C)C[NH+]2CCC(CC2)OC3=CC=C(C=C3)C(=O)N4CCCCC4

InChI

InChI=1S/C23H32N4O2/c1-18-20(16-24-25(18)2)17-26-14-10-22(11-15-26)29-21-8-6-19(7-9-21)23(28)27-12-4-3-5-13-27/h6-9,16,22H,3-5,10-15,17H2,1-2H3/p+1