[(3S,4S)-1-cyclobutylcarbonyl-4-oxidanyl-pyrrolidin-3-yl]-methyl-[(4-pyrazol-1-ylphenyl)methyl]azanium

Systemtic Name: [(3S,4S)-1-cyclobutylcarbonyl-4-oxidanyl-pyrrolidin-3-yl]-methyl-[(4-pyrazol-1-ylphenyl)methyl]azanium Openeye Name: [(3S,4S)-1-(cyclobutanecarbonyl)-4-hydroxy-pyrrolidin-3-yl]-methyl-[(4-pyrazol-1-ylphenyl)methyl]ammonium CAS Name: [(3S,4S)-1-[cyclobutyl(oxo)methyl]-4-hydroxy-3-pyrrolidinyl]-methyl-[[4-(1-pyrazolyl)phenyl]methyl]ammonium IUPAC Name: [(3S,4S)-1-(cyclobutanecarbonyl)-4-hydroxypyrrolidin-3-yl]-methyl-[(4-pyrazol-1-ylphenyl)methyl]azanium Traditional Name: [(3S,4S)-1-(cyclobutanecarbonyl)-4-hydroxy-pyrrolidin-3-yl]-methyl-(4-pyrazol-1-ylbenzyl)ammonium Formula: C20H27N4O2+ MolecularWeight: 355.45398

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=C(C=C1)N2C=CC=N2)C3CN(CC3O)C(=O)C4CCC4

Isomeric SMILES

C[NH+](CC1=CC=C(C=C1)N2C=CC=N2)[C@H]3CN(C[C@@H]3O)C(=O)C4CCC4

InChI

InChI=1S/C20H26N4O2/c1-22(12-15-6-8-17(9-7-15)24-11-3-10-21-24)18-13-23(14-19(18)25)20(26)16-4-2-5-16/h3,6-11,16,18-19,25H,2,4-5,12-14H2,1H3/p+1/t18-,19-/m0/s1