[4-[1-[(4-methoxy-3-methyl-phenyl)methyl]piperidin-1-ium-4-yl]oxyphenyl]-piperidin-1-yl-methanone

Systemtic Name: [4-[1-[(4-methoxy-3-methyl-phenyl)methyl]piperidin-1-ium-4-yl]oxyphenyl]-piperidin-1-yl-methanone Openeye Name: [4-[1-[(4-methoxy-3-methyl-phenyl)methyl]piperidin-1-ium-4-yl]oxyphenyl]-(1-piperidyl)methanone CAS Name: [4-[[1-[(4-methoxy-3-methylphenyl)methyl]-4-piperidin-1-iumyl]oxy]phenyl]-(1-piperidinyl)methanone IUPAC Name: [4-[1-[(4-methoxy-3-methylphenyl)methyl]piperidin-1-ium-4-yl]oxyphenyl]-piperidin-1-ylmethanone Traditional Name: [4-[1-(4-methoxy-3-methyl-benzyl)piperidin-1-ium-4-yl]oxyphenyl]-piperidino-methanone Formula: C26H35N2O3+ MolecularWeight: 423.5677

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C[NH+]2CCC(CC2)OC3=CC=C(C=C3)C(=O)N4CCCCC4)OC

Isomeric SMILES

CC1=C(C=CC(=C1)C[NH+]2CCC(CC2)OC3=CC=C(C=C3)C(=O)N4CCCCC4)OC

InChI

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