[(3S)-1-[5-chloranyl-2-(1-ethanoylpiperidin-4-yl)oxy-phenyl]carbonylpyrrolidin-3-yl]-diethyl-azanium

Systemtic Name: [(3S)-1-[5-chloranyl-2-(1-ethanoylpiperidin-4-yl)oxy-phenyl]carbonylpyrrolidin-3-yl]-diethyl-azanium Openeye Name: [(3S)-1-[2-[(1-acetyl-4-piperidyl)oxy]-5-chloro-benzoyl]pyrrolidin-3-yl]-diethyl-ammonium CAS Name: [(3S)-1-[[2-[(1-acetyl-4-piperidinyl)oxy]-5-chlorophenyl]-oxomethyl]-3-pyrrolidinyl]-diethylammonium IUPAC Name: [(3S)-1-[2-(1-acetylpiperidin-4-yl)oxy-5-chlorobenzoyl]pyrrolidin-3-yl]-diethylazanium Traditional Name: [(3S)-1-[2-[(1-acetyl-4-piperidyl)oxy]-5-chloro-benzoyl]pyrrolidin-3-yl]-diethyl-ammonium Formula: C22H33ClN3O3+ MolecularWeight: 422.96872

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)C1CCN(C1)C(=O)C2=C(C=CC(=C2)Cl)OC3CCN(CC3)C(=O)C

Isomeric SMILES

CC[NH+](CC)[C@H]1CCN(C1)C(=O)C2=C(C=CC(=C2)Cl)OC3CCN(CC3)C(=O)C

InChI

InChI=1S/C22H32ClN3O3/c1-4-24(5-2)18-8-11-26(15-18)22(28)20-14-17(23)6-7-21(20)29-19-9-12-25(13-10-19)16(3)27/h6-7,14,18-19H,4-5,8-13,15H2,1-3H3/p+1/t18-/m0/s1