[2-[1-[(1-ethylpyrazol-4-yl)methyl]piperidin-1-ium-4-yl]oxy-4-methoxy-phenyl]-pyrrolidin-1-yl-methanone

Systemtic Name: [2-[1-[(1-ethylpyrazol-4-yl)methyl]piperidin-1-ium-4-yl]oxy-4-methoxy-phenyl]-pyrrolidin-1-yl-methanone Openeye Name: [2-[1-[(1-ethylpyrazol-4-yl)methyl]piperidin-1-ium-4-yl]oxy-4-methoxy-phenyl]-pyrrolidin-1-yl-methanone CAS Name: [2-[[1-[(1-ethyl-4-pyrazolyl)methyl]-4-piperidin-1-iumyl]oxy]-4-methoxyphenyl]-(1-pyrrolidinyl)methanone IUPAC Name: [2-[1-[(1-ethylpyrazol-4-yl)methyl]piperidin-1-ium-4-yl]oxy-4-methoxyphenyl]-pyrrolidin-1-ylmethanone Traditional Name: [2-[1-[(1-ethylpyrazol-4-yl)methyl]piperidin-1-ium-4-yl]oxy-4-methoxy-phenyl]-pyrrolidino-methanone Formula: C23H33N4O3+ MolecularWeight: 413.53312

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H32N4O3/c1-3-27-17-18(15-24-27)16-25-12-8-19(9-13-25)30-22-14-20(29-2)6-7-21(22)23(28)26-10-4-5-11-26/h6-7,14-15,17,19H,3-5,8-13,16H2,1-2H3/p+1