(1,5-dimethylpyrazol-3-yl)-[4-[(3R)-1-phenethylpyrrolidin-1-ium-3-yl]piperidin-1-yl]methanone

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C)C(=O)N2CCC(CC2)C3CC[NH+](C3)CCC4=CC=CC=C4

Isomeric SMILES

CC1=CC(=NN1C)C(=O)N2CCC(CC2)[C@H]3CC[NH+](C3)CCC4=CC=CC=C4

InChI

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