(2R)-1-cyclobutyl-N-(3-pyrazol-1-ylphenyl)pyrrolidin-1-ium-2-carboxamide

Systemtic Name: (2R)-1-cyclobutyl-N-(3-pyrazol-1-ylphenyl)pyrrolidin-1-ium-2-carboxamide Openeye Name: (2R)-1-cyclobutyl-N-(3-pyrazol-1-ylphenyl)pyrrolidin-1-ium-2-carboxamide CAS Name: (2R)-1-cyclobutyl-N-[3-(1-pyrazolyl)phenyl]-2-pyrrolidin-1-iumcarboxamide IUPAC Name: (2R)-1-cyclobutyl-N-(3-pyrazol-1-ylphenyl)pyrrolidin-1-ium-2-carboxamide Traditional Name: (2R)-1-cyclobutyl-N-(3-pyrazol-1-ylphenyl)pyrrolidin-1-ium-2-carboxamide Formula: C18H23N4O+ MolecularWeight: 311.40142

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C1)[NH+]2CCCC2C(=O)NC3=CC=CC(=C3)N4C=CC=N4

Isomeric SMILES

C1C[C@@H]([NH+](C1)C2CCC2)C(=O)NC3=CC=CC(=C3)N4C=CC=N4

InChI

InChI=1S/C18H22N4O/c23-18(17-9-3-11-21(17)15-6-2-7-15)20-14-5-1-8-16(13-14)22-12-4-10-19-22/h1,4-5,8,10,12-13,15,17H,2-3,6-7,9,11H2,(H,20,23)/p+1/t17-/m1/s1