[(2R)-6-methyl-6-oxidanyl-heptan-2-yl]-[(3S)-1-phenylpyrrolidin-3-yl]azanium

Systemtic Name: [(2R)-6-methyl-6-oxidanyl-heptan-2-yl]-[(3S)-1-phenylpyrrolidin-3-yl]azanium Openeye Name: [(1R)-5-hydroxy-1,5-dimethyl-hexyl]-[(3S)-1-phenylpyrrolidin-3-yl]ammonium CAS Name: [(2R)-6-hydroxy-6-methylheptan-2-yl]-[(3S)-1-phenyl-3-pyrrolidinyl]ammonium IUPAC Name: [(2R)-6-hydroxy-6-methylheptan-2-yl]-[(3S)-1-phenylpyrrolidin-3-yl]azanium Traditional Name: [(1R)-5-hydroxy-1,5-dimethyl-hexyl]-[(3S)-1-phenylpyrrolidin-3-yl]ammonium Formula: C18H31N2O+ MolecularWeight: 291.45154

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCC(C)(C)O)[NH2+]C1CCN(C1)C2=CC=CC=C2

Isomeric SMILES

C[C@H](CCCC(C)(C)O)[NH2+][C@H]1CCN(C1)C2=CC=CC=C2

InChI

InChI=1S/C18H30N2O/c1-15(8-7-12-18(2,3)21)19-16-11-13-20(14-16)17-9-5-4-6-10-17/h4-6,9-10,15-16,19,21H,7-8,11-14H2,1-3H3/p+1/t15-,16+/m1/s1