piperidin-1-yl-[2-[1-(quinolin-2-ylmethyl)piperidin-1-ium-4-yl]oxyphenyl]methanone

Systemtic Name: piperidin-1-yl-[2-[1-(quinolin-2-ylmethyl)piperidin-1-ium-4-yl]oxyphenyl]methanone Openeye Name: 1-piperidyl-[2-[1-(2-quinolylmethyl)piperidin-1-ium-4-yl]oxyphenyl]methanone CAS Name: 1-piperidinyl-[2-[[1-(2-quinolinylmethyl)-4-piperidin-1-iumyl]oxy]phenyl]methanone IUPAC Name: piperidin-1-yl-[2-[1-(quinolin-2-ylmethyl)piperidin-1-ium-4-yl]oxyphenyl]methanone Traditional Name: piperidino-[2-[1-(2-quinolylmethyl)piperidin-1-ium-4-yl]oxyphenyl]methanone Formula: C27H32N3O2+ MolecularWeight: 430.56188

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C2=CC=CC=C2OC3CC[NH+](CC3)CC4=NC5=CC=CC=C5C=C4

Isomeric SMILES

C1CCN(CC1)C(=O)C2=CC=CC=C2OC3CC[NH+](CC3)CC4=NC5=CC=CC=C5C=C4

InChI

InChI=1S/C27H31N3O2/c31-27(30-16-6-1-7-17-30)24-9-3-5-11-26(24)32-23-14-18-29(19-15-23)20-22-13-12-21-8-2-4-10-25(21)28-22/h2-5,8-13,23H,1,6-7,14-20H2/p+1