[(4R)-4-cyclopentyl-4-oxidanyl-4-phenyl-but-2-ynyl]-dipropyl-azanium

Systemtic Name: [(4R)-4-cyclopentyl-4-oxidanyl-4-phenyl-but-2-ynyl]-dipropyl-azanium Openeye Name: [(4R)-4-cyclopentyl-4-hydroxy-4-phenyl-but-2-ynyl]-dipropyl-ammonium CAS Name: [(4R)-4-cyclopentyl-4-hydroxy-4-phenylbut-2-ynyl]-dipropylammonium IUPAC Name: [(4R)-4-cyclopentyl-4-hydroxy-4-phenylbut-2-ynyl]-dipropylazanium Traditional Name: [(4R)-4-cyclopentyl-4-hydroxy-4-phenyl-but-2-ynyl]-dipropyl-ammonium Formula: C21H32NO+ MolecularWeight: 314.48488

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+](CCC)CC#CC(C1CCCC1)(C2=CC=CC=C2)O

Isomeric SMILES

CCC[NH+](CCC)CC#C[C@@](C1CCCC1)(C2=CC=CC=C2)O

InChI

InChI=1S/C21H31NO/c1-3-16-22(17-4-2)18-10-15-21(23,20-13-8-9-14-20)19-11-6-5-7-12-19/h5-7,11-12,20,23H,3-4,8-9,13-14,16-18H2,1-2H3/p+1/t21-/m0/s1