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

Systemtic Name: [4-[1-[(2R)-4-phenylbutan-2-yl]piperidin-1-ium-4-yl]oxyphenyl]-pyrrolidin-1-yl-methanone Openeye Name: [4-[1-[(1R)-1-methyl-3-phenyl-propyl]piperidin-1-ium-4-yl]oxyphenyl]-pyrrolidin-1-yl-methanone CAS Name: [4-[[1-[(2R)-4-phenylbutan-2-yl]-4-piperidin-1-iumyl]oxy]phenyl]-(1-pyrrolidinyl)methanone IUPAC Name: [4-[1-[(2R)-4-phenylbutan-2-yl]piperidin-1-ium-4-yl]oxyphenyl]-pyrrolidin-1-ylmethanone Traditional Name: [4-[1-[(1R)-1-methyl-3-phenyl-propyl]piperidin-1-ium-4-yl]oxyphenyl]-pyrrolidino-methanone Formula: C26H35N2O2+ MolecularWeight: 407.5683

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=CC=C1)[NH+]2CCC(CC2)OC3=CC=C(C=C3)C(=O)N4CCCC4

Isomeric SMILES

C[C@H](CCC1=CC=CC=C1)[NH+]2CCC(CC2)OC3=CC=C(C=C3)C(=O)N4CCCC4

InChI

InChI=1S/C26H34N2O2/c1-21(9-10-22-7-3-2-4-8-22)27-19-15-25(16-20-27)30-24-13-11-23(12-14-24)26(29)28-17-5-6-18-28/h2-4,7-8,11-14,21,25H,5-6,9-10,15-20H2,1H3/p+1/t21-/m1/s1