N-[(2R)-2-(2-chlorophenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-3,5-dimethyl-1-phenyl-pyrazole-4-carboxamide

Systemtic Name: N-[(2R)-2-(2-chlorophenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-3,5-dimethyl-1-phenyl-pyrazole-4-carboxamide Openeye Name: N-[(2R)-2-(2-chlorophenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-3,5-dimethyl-1-phenyl-pyrazole-4-carboxamide CAS Name: N-[(2R)-2-(2-chlorophenyl)-2-(1-pyrrolidin-1-iumyl)ethyl]-3,5-dimethyl-1-phenyl-4-pyrazolecarboxamide IUPAC Name: N-[(2R)-2-(2-chlorophenyl)-2-pyrrolidin-1-ium-1-ylethyl]-3,5-dimethyl-1-phenylpyrazole-4-carboxamide Traditional Name: N-[(2R)-2-(2-chlorophenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-3,5-dimethyl-1-phenyl-pyrazole-4-carboxamide Formula: C24H28ClN4O+ MolecularWeight: 423.95832

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)C(=O)NCC(C3=CC=CC=C3Cl)[NH+]4CCCC4

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)C(=O)NC[C@@H](C3=CC=CC=C3Cl)[NH+]4CCCC4

InChI

InChI=1S/C24H27ClN4O/c1-17-23(18(2)29(27-17)19-10-4-3-5-11-19)24(30)26-16-22(28-14-8-9-15-28)20-12-6-7-13-21(20)25/h3-7,10-13,22H,8-9,14-16H2,1-2H3,(H,26,30)/p+1/t22-/m0/s1