[4-methoxy-2-[1-(3-pyrazol-1-ylpropyl)piperidin-1-ium-4-yl]oxy-phenyl]-pyrrolidin-1-yl-methanone

Systemtic Name: [4-methoxy-2-[1-(3-pyrazol-1-ylpropyl)piperidin-1-ium-4-yl]oxy-phenyl]-pyrrolidin-1-yl-methanone Openeye Name: [4-methoxy-2-[1-(3-pyrazol-1-ylpropyl)piperidin-1-ium-4-yl]oxy-phenyl]-pyrrolidin-1-yl-methanone CAS Name: [4-methoxy-2-[[1-[3-(1-pyrazolyl)propyl]-4-piperidin-1-iumyl]oxy]phenyl]-(1-pyrrolidinyl)methanone IUPAC Name: [4-methoxy-2-[1-(3-pyrazol-1-ylpropyl)piperidin-1-ium-4-yl]oxyphenyl]-pyrrolidin-1-ylmethanone Traditional Name: [4-methoxy-2-[1-(3-pyrazol-1-ylpropyl)piperidin-1-ium-4-yl]oxy-phenyl]-pyrrolidino-methanone Formula: C23H33N4O3+ MolecularWeight: 413.53312

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C(=O)N2CCCC2)OC3CC[NH+](CC3)CCCN4C=CC=N4

Isomeric SMILES

COC1=CC(=C(C=C1)C(=O)N2CCCC2)OC3CC[NH+](CC3)CCCN4C=CC=N4

InChI

InChI=1S/C23H32N4O3/c1-29-20-6-7-21(23(28)26-12-2-3-13-26)22(18-20)30-19-8-16-25(17-9-19)11-5-15-27-14-4-10-24-27/h4,6-7,10,14,18-19H,2-3,5,8-9,11-13,15-17H2,1H3/p+1