4-chloranyl-5-[[(2R)-2-(2-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]amino]-2-phenyl-pyridazin-3-one

Systemtic Name: 4-chloranyl-5-[[(2R)-2-(2-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]amino]-2-phenyl-pyridazin-3-one Openeye Name: 4-chloro-5-[[(2R)-2-(2-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]amino]-2-phenyl-pyridazin-3-one CAS Name: 4-chloro-5-[[(2R)-2-(2-methoxyphenyl)-2-(1-pyrrolidin-1-iumyl)ethyl]amino]-2-phenyl-3-pyridazinone IUPAC Name: 4-chloro-5-[[(2R)-2-(2-methoxyphenyl)-2-pyrrolidin-1-ium-1-ylethyl]amino]-2-phenylpyridazin-3-one Traditional Name: 4-chloro-5-[[(2R)-2-(2-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]amino]-2-phenyl-pyridazin-3-one Formula: C23H26ClN4O2+ MolecularWeight: 425.93114

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C(CNC2=C(C(=O)N(N=C2)C3=CC=CC=C3)Cl)[NH+]4CCCC4

Isomeric SMILES

COC1=CC=CC=C1[C@H](CNC2=C(C(=O)N(N=C2)C3=CC=CC=C3)Cl)[NH+]4CCCC4

InChI

InChI=1S/C23H25ClN4O2/c1-30-21-12-6-5-11-18(21)20(27-13-7-8-14-27)16-25-19-15-26-28(23(29)22(19)24)17-9-3-2-4-10-17/h2-6,9-12,15,20,25H,7-8,13-14,16H2,1H3/p+1/t20-/m0/s1