3-(3-azanylphenoxy)propyl-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-ethyl-azanium

Systemtic Name: 3-(3-azanylphenoxy)propyl-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-ethyl-azanium Openeye Name: 3-(3-aminophenoxy)propyl-[(3S)-1,1-dioxothiolan-3-yl]-ethyl-ammonium CAS Name: 3-(3-aminophenoxy)propyl-[(3S)-1,1-dioxo-3-thiolanyl]-ethylammonium IUPAC Name: 3-(3-aminophenoxy)propyl-[(3S)-1,1-dioxothiolan-3-yl]-ethylazanium Traditional Name: 3-(3-aminophenoxy)propyl-[(3S)-1,1-diketothiolan-3-yl]-ethyl-ammonium Formula: C15H25N2O3S+ MolecularWeight: 313.4356

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CCCOC1=CC=CC(=C1)N)C2CCS(=O)(=O)C2

Isomeric SMILES

CC[NH+](CCCOC1=CC=CC(=C1)N)[C@H]2CCS(=O)(=O)C2

InChI

InChI=1S/C15H24N2O3S/c1-2-17(14-7-10-21(18,19)12-14)8-4-9-20-15-6-3-5-13(16)11-15/h3,5-6,11,14H,2,4,7-10,12,16H2,1H3/p+1/t14-/m0/s1