[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-[(4-methoxycarbonylphenyl)methyl]azanium

Systemtic Name: [(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-[(4-methoxycarbonylphenyl)methyl]azanium Openeye Name: [(3S)-1,1-dioxothiolan-3-yl]-[(4-methoxycarbonylphenyl)methyl]ammonium CAS Name: [(3S)-1,1-dioxo-3-thiolanyl]-[(4-methoxycarbonylphenyl)methyl]ammonium IUPAC Name: [(3S)-1,1-dioxothiolan-3-yl]-[(4-methoxycarbonylphenyl)methyl]azanium Traditional Name: (4-carbomethoxybenzyl)-[(3S)-1,1-diketothiolan-3-yl]ammonium Formula: C13H18NO4S+ MolecularWeight: 284.35132

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C[NH2+]C2CCS(=O)(=O)C2

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C[NH2+][C@H]2CCS(=O)(=O)C2

InChI

InChI=1S/C13H17NO4S/c1-18-13(15)11-4-2-10(3-5-11)8-14-12-6-7-19(16,17)9-12/h2-5,12,14H,6-9H2,1H3/p+1/t12-/m0/s1