pyrrolidin-1-yl-[4-[1-[(2,4,5-trimethylphenyl)methyl]piperidin-1-ium-4-yl]oxyphenyl]methanone

Systemtic Name: pyrrolidin-1-yl-[4-[1-[(2,4,5-trimethylphenyl)methyl]piperidin-1-ium-4-yl]oxyphenyl]methanone Openeye Name: pyrrolidin-1-yl-[4-[1-[(2,4,5-trimethylphenyl)methyl]piperidin-1-ium-4-yl]oxyphenyl]methanone CAS Name: 1-pyrrolidinyl-[4-[[1-[(2,4,5-trimethylphenyl)methyl]-4-piperidin-1-iumyl]oxy]phenyl]methanone IUPAC Name: pyrrolidin-1-yl-[4-[1-[(2,4,5-trimethylphenyl)methyl]piperidin-1-ium-4-yl]oxyphenyl]methanone Traditional Name: pyrrolidino-[4-[1-(2,4,5-trimethylbenzyl)piperidin-1-ium-4-yl]oxyphenyl]methanone Formula: C26H35N2O2+ MolecularWeight: 407.5683

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C)C[NH+]2CCC(CC2)OC3=CC=C(C=C3)C(=O)N4CCCC4)C

Isomeric SMILES

CC1=CC(=C(C=C1C)C[NH+]2CCC(CC2)OC3=CC=C(C=C3)C(=O)N4CCCC4)C

InChI

InChI=1S/C26H34N2O2/c1-19-16-21(3)23(17-20(19)2)18-27-14-10-25(11-15-27)30-24-8-6-22(7-9-24)26(29)28-12-4-5-13-28/h6-9,16-17,25H,4-5,10-15,18H2,1-3H3/p+1