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

Systemtic Name: 4-chloranyl-5-[[(2R)-4-methyl-2-pyrrolidin-1-ium-1-yl-pentyl]amino]-2-phenyl-pyridazin-3-one Openeye Name: 4-chloro-5-[[(2R)-4-methyl-2-pyrrolidin-1-ium-1-yl-pentyl]amino]-2-phenyl-pyridazin-3-one CAS Name: 4-chloro-5-[[(2R)-4-methyl-2-(1-pyrrolidin-1-iumyl)pentyl]amino]-2-phenyl-3-pyridazinone IUPAC Name: 4-chloro-5-[[(2R)-4-methyl-2-pyrrolidin-1-ium-1-ylpentyl]amino]-2-phenylpyridazin-3-one Traditional Name: 4-chloro-5-[[(2R)-4-methyl-2-pyrrolidin-1-ium-1-yl-pentyl]amino]-2-phenyl-pyridazin-3-one Formula: C20H28ClN4O+ MolecularWeight: 375.91552

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(CNC1=C(C(=O)N(N=C1)C2=CC=CC=C2)Cl)[NH+]3CCCC3

Isomeric SMILES

CC(C)C[C@H](CNC1=C(C(=O)N(N=C1)C2=CC=CC=C2)Cl)[NH+]3CCCC3

InChI

InChI=1S/C20H27ClN4O/c1-15(2)12-17(24-10-6-7-11-24)13-22-18-14-23-25(20(26)19(18)21)16-8-4-3-5-9-16/h3-5,8-9,14-15,17,22H,6-7,10-13H2,1-2H3/p+1/t17-/m1/s1