[(3R,4S)-1,1-bis(oxidanylidene)-4-phenylazanyl-thiolan-3-yl]-propyl-azanium

Systemtic Name: [(3R,4S)-1,1-bis(oxidanylidene)-4-phenylazanyl-thiolan-3-yl]-propyl-azanium Openeye Name: [(3R,4S)-4-anilino-1,1-dioxo-thiolan-3-yl]-propyl-ammonium CAS Name: [(3R,4S)-4-anilino-1,1-dioxo-3-thiolanyl]-propylammonium IUPAC Name: [(3R,4S)-4-anilino-1,1-dioxothiolan-3-yl]-propylazanium Traditional Name: [(3R,4S)-4-anilino-1,1-diketo-thiolan-3-yl]-propyl-ammonium Formula: C13H21N2O2S+ MolecularWeight: 269.38304

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH2+]C1CS(=O)(=O)CC1NC2=CC=CC=C2

Isomeric SMILES

CCC[NH2+][C@H]1CS(=O)(=O)C[C@H]1NC2=CC=CC=C2

InChI

InChI=1S/C13H20N2O2S/c1-2-8-14-12-9-18(16,17)10-13(12)15-11-6-4-3-5-7-11/h3-7,12-15H,2,8-10H2,1H3/p+1/t12-,13+/m0/s1