[4-[1-[(1-ethyl-5-methyl-pyrazol-4-yl)methyl]piperidin-1-ium-4-yl]oxyphenyl]-pyrrolidin-1-yl-methanone

Systemtic Name: [4-[1-[(1-ethyl-5-methyl-pyrazol-4-yl)methyl]piperidin-1-ium-4-yl]oxyphenyl]-pyrrolidin-1-yl-methanone Openeye Name: [4-[1-[(1-ethyl-5-methyl-pyrazol-4-yl)methyl]piperidin-1-ium-4-yl]oxyphenyl]-pyrrolidin-1-yl-methanone CAS Name: [4-[[1-[(1-ethyl-5-methyl-4-pyrazolyl)methyl]-4-piperidin-1-iumyl]oxy]phenyl]-(1-pyrrolidinyl)methanone IUPAC Name: [4-[1-[(1-ethyl-5-methylpyrazol-4-yl)methyl]piperidin-1-ium-4-yl]oxyphenyl]-pyrrolidin-1-ylmethanone Traditional Name: [4-[1-[(1-ethyl-5-methyl-pyrazol-4-yl)methyl]piperidin-1-ium-4-yl]oxyphenyl]-pyrrolidino-methanone Formula: C23H33N4O2+ MolecularWeight: 397.53372

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C=N1)C[NH+]2CCC(CC2)OC3=CC=C(C=C3)C(=O)N4CCCC4)C

Isomeric SMILES

CCN1C(=C(C=N1)C[NH+]2CCC(CC2)OC3=CC=C(C=C3)C(=O)N4CCCC4)C

InChI

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