(2R)-2-[[(3S)-1-(phenylmethyl)pyrrolidin-1-ium-3-yl]amino]butan-1-ol

Systemtic Name: (2R)-2-[[(3S)-1-(phenylmethyl)pyrrolidin-1-ium-3-yl]amino]butan-1-ol Openeye Name: (2R)-2-[[(3S)-1-benzylpyrrolidin-1-ium-3-yl]amino]butan-1-ol CAS Name: (2R)-2-[[(3S)-1-(phenylmethyl)-3-pyrrolidin-1-iumyl]amino]-1-butanol IUPAC Name: (2R)-2-[[(3S)-1-benzylpyrrolidin-1-ium-3-yl]amino]butan-1-ol Traditional Name: (2R)-2-[[(3S)-1-benzylpyrrolidin-1-ium-3-yl]amino]butan-1-ol Formula: C15H25N2O+ MolecularWeight: 249.3718

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CO)NC1CC[NH+](C1)CC2=CC=CC=C2

Isomeric SMILES

CC[C@H](CO)N[C@H]1CC[NH+](C1)CC2=CC=CC=C2

InChI

InChI=1S/C15H24N2O/c1-2-14(12-18)16-15-8-9-17(11-15)10-13-6-4-3-5-7-13/h3-7,14-16,18H,2,8-12H2,1H3/p+1/t14-,15+/m1/s1