(1,5-dimethylpyrazol-3-yl)-[(3R)-3-(1-phenethylpiperidin-1-ium-4-yl)pyrrolidin-1-yl]methanone

Systemtic Name: (1,5-dimethylpyrazol-3-yl)-[(3R)-3-(1-phenethylpiperidin-1-ium-4-yl)pyrrolidin-1-yl]methanone Openeye Name: (1,5-dimethylpyrazol-3-yl)-[(3R)-3-(1-phenethylpiperidin-1-ium-4-yl)pyrrolidin-1-yl]methanone CAS Name: (1,5-dimethyl-3-pyrazolyl)-[(3R)-3-(1-phenethyl-4-piperidin-1-iumyl)-1-pyrrolidinyl]methanone IUPAC Name: (1,5-dimethylpyrazol-3-yl)-[(3R)-3-(1-phenethylpiperidin-1-ium-4-yl)pyrrolidin-1-yl]methanone Traditional Name: (1,5-dimethylpyrazol-3-yl)-[(3R)-3-(1-phenethylpiperidin-1-ium-4-yl)pyrrolidino]methanone Formula: C23H33N4O+ MolecularWeight: 381.53432

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C)C(=O)N2CCC(C2)C3CC[NH+](CC3)CCC4=CC=CC=C4

Isomeric SMILES

CC1=CC(=NN1C)C(=O)N2CC[C@@H](C2)C3CC[NH+](CC3)CCC4=CC=CC=C4

InChI

InChI=1S/C23H32N4O/c1-18-16-22(24-25(18)2)23(28)27-15-11-21(17-27)20-9-13-26(14-10-20)12-8-19-6-4-3-5-7-19/h3-7,16,20-21H,8-15,17H2,1-2H3/p+1/t21-/m0/s1