[(2S)-1-(3-phenoxypropanoyl)pyrrolidin-2-yl]methylazanium

Systemtic Name: [(2S)-1-(3-phenoxypropanoyl)pyrrolidin-2-yl]methylazanium Openeye Name: [(2S)-1-(3-phenoxypropanoyl)pyrrolidin-2-yl]methylammonium CAS Name: [(2S)-1-(1-oxo-3-phenoxypropyl)-2-pyrrolidinyl]methylammonium IUPAC Name: [(2S)-1-(3-phenoxypropanoyl)pyrrolidin-2-yl]methylazanium Traditional Name: [(2S)-1-(3-phenoxypropanoyl)pyrrolidin-2-yl]methylammonium Formula: C14H21N2O2+ MolecularWeight: 249.32874

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)CCOC2=CC=CC=C2)C[NH3+]

Isomeric SMILES

C1C[C@H](N(C1)C(=O)CCOC2=CC=CC=C2)C[NH3+]

InChI

InChI=1S/C14H20N2O2/c15-11-12-5-4-9-16(12)14(17)8-10-18-13-6-2-1-3-7-13/h1-3,6-7,12H,4-5,8-11,15H2/p+1/t12-/m0/s1