5-chloranyl-3-methyl-1-phenyl-N-[(2R)-2-phenyl-2-pyrrolidin-1-ium-1-yl-ethyl]pyrazole-4-carboxamide

Systemtic Name: 5-chloranyl-3-methyl-1-phenyl-N-[(2R)-2-phenyl-2-pyrrolidin-1-ium-1-yl-ethyl]pyrazole-4-carboxamide Openeye Name: 5-chloro-3-methyl-1-phenyl-N-[(2R)-2-phenyl-2-pyrrolidin-1-ium-1-yl-ethyl]pyrazole-4-carboxamide CAS Name: 5-chloro-3-methyl-1-phenyl-N-[(2R)-2-phenyl-2-(1-pyrrolidin-1-iumyl)ethyl]-4-pyrazolecarboxamide IUPAC Name: 5-chloro-3-methyl-1-phenyl-N-[(2R)-2-phenyl-2-pyrrolidin-1-ium-1-ylethyl]pyrazole-4-carboxamide Traditional Name: 5-chloro-3-methyl-1-phenyl-N-[(2R)-2-phenyl-2-pyrrolidin-1-ium-1-yl-ethyl]pyrazole-4-carboxamide Formula: C23H26ClN4O+ MolecularWeight: 409.93174

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)NCC(C2=CC=CC=C2)[NH+]3CCCC3)Cl)C4=CC=CC=C4

Isomeric SMILES

CC1=NN(C(=C1C(=O)NC[C@@H](C2=CC=CC=C2)[NH+]3CCCC3)Cl)C4=CC=CC=C4

InChI

InChI=1S/C23H25ClN4O/c1-17-21(22(24)28(26-17)19-12-6-3-7-13-19)23(29)25-16-20(27-14-8-9-15-27)18-10-4-2-5-11-18/h2-7,10-13,20H,8-9,14-16H2,1H3,(H,25,29)/p+1/t20-/m0/s1