[4-[1-(2-methylpropyl)piperidin-1-ium-4-yl]oxyphenyl]-pyrrolidin-1-yl-methanone

Systemtic Name: [4-[1-(2-methylpropyl)piperidin-1-ium-4-yl]oxyphenyl]-pyrrolidin-1-yl-methanone Openeye Name: [4-(1-isobutylpiperidin-1-ium-4-yl)oxyphenyl]-pyrrolidin-1-yl-methanone CAS Name: [4-[[1-(2-methylpropyl)-4-piperidin-1-iumyl]oxy]phenyl]-(1-pyrrolidinyl)methanone IUPAC Name: [4-[1-(2-methylpropyl)piperidin-1-ium-4-yl]oxyphenyl]-pyrrolidin-1-ylmethanone Traditional Name: [4-(1-isobutylpiperidin-1-ium-4-yl)oxyphenyl]-pyrrolidino-methanone Formula: C20H31N2O2+ MolecularWeight: 331.47234

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C[NH+]1CCC(CC1)OC2=CC=C(C=C2)C(=O)N3CCCC3

Isomeric SMILES

CC(C)C[NH+]1CCC(CC1)OC2=CC=C(C=C2)C(=O)N3CCCC3

InChI

InChI=1S/C20H30N2O2/c1-16(2)15-21-13-9-19(10-14-21)24-18-7-5-17(6-8-18)20(23)22-11-3-4-12-22/h5-8,16,19H,3-4,9-15H2,1-2H3/p+1