(3-ethynylphenyl)-[(2S)-1-oxidanylidene-1-pyrrolidin-1-yl-propan-2-yl]azanium

Systemtic Name: (3-ethynylphenyl)-[(2S)-1-oxidanylidene-1-pyrrolidin-1-yl-propan-2-yl]azanium Openeye Name: (3-ethynylphenyl)-[(1S)-1-methyl-2-oxo-2-pyrrolidin-1-yl-ethyl]ammonium CAS Name: (3-ethynylphenyl)-[(2S)-1-oxo-1-(1-pyrrolidinyl)propan-2-yl]ammonium IUPAC Name: (3-ethynylphenyl)-[(2S)-1-oxo-1-pyrrolidin-1-ylpropan-2-yl]azanium Traditional Name: (3-ethynylphenyl)-[(1S)-2-keto-1-methyl-2-pyrrolidino-ethyl]ammonium Formula: C15H19N2O+ MolecularWeight: 243.32416

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCCC1)[NH2+]C2=CC=CC(=C2)C#C

Isomeric SMILES

C[C@@H](C(=O)N1CCCC1)[NH2+]C2=CC=CC(=C2)C#C

InChI

InChI=1S/C15H18N2O/c1-3-13-7-6-8-14(11-13)16-12(2)15(18)17-9-4-5-10-17/h1,6-8,11-12,16H,4-5,9-10H2,2H3/p+1/t12-/m0/s1