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

Systemtic Name: [4-[1-[(4-methoxy-2,5-dimethyl-phenyl)methyl]piperidin-1-ium-4-yl]oxyphenyl]-pyrrolidin-1-yl-methanone Openeye Name: [4-[1-[(4-methoxy-2,5-dimethyl-phenyl)methyl]piperidin-1-ium-4-yl]oxyphenyl]-pyrrolidin-1-yl-methanone CAS Name: [4-[[1-[(4-methoxy-2,5-dimethylphenyl)methyl]-4-piperidin-1-iumyl]oxy]phenyl]-(1-pyrrolidinyl)methanone IUPAC Name: [4-[1-[(4-methoxy-2,5-dimethylphenyl)methyl]piperidin-1-ium-4-yl]oxyphenyl]-pyrrolidin-1-ylmethanone Traditional Name: [4-[1-(4-methoxy-2,5-dimethyl-benzyl)piperidin-1-ium-4-yl]oxyphenyl]-pyrrolidino-methanone Formula: C26H35N2O3+ MolecularWeight: 423.5677

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H34N2O3/c1-19-17-25(30-3)20(2)16-22(19)18-27-14-10-24(11-15-27)31-23-8-6-21(7-9-23)26(29)28-12-4-5-13-28/h6-9,16-17,24H,4-5,10-15,18H2,1-3H3/p+1