[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-[(3-methoxycarbonyl-2-oxidanyl-naphthalen-1-yl)methyl]-methyl-azanium

Systemtic Name: [(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-[(3-methoxycarbonyl-2-oxidanyl-naphthalen-1-yl)methyl]-methyl-azanium Openeye Name: [(3S)-1,1-dioxothiolan-3-yl]-[(2-hydroxy-3-methoxycarbonyl-1-naphthyl)methyl]-methyl-ammonium CAS Name: [(3S)-1,1-dioxo-3-thiolanyl]-[(2-hydroxy-3-methoxycarbonyl-1-naphthalenyl)methyl]-methylammonium IUPAC Name: [(3S)-1,1-dioxothiolan-3-yl]-[(2-hydroxy-3-methoxycarbonylnaphthalen-1-yl)methyl]-methylazanium Traditional Name: (3-carbomethoxy-2-hydroxy-1-naphthyl)methyl-[(3S)-1,1-diketothiolan-3-yl]-methyl-ammonium Formula: C18H22NO5S+ MolecularWeight: 364.43598

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=C(C(=CC2=CC=CC=C21)C(=O)OC)O)C3CCS(=O)(=O)C3

Isomeric SMILES

C[NH+](CC1=C(C(=CC2=CC=CC=C21)C(=O)OC)O)[C@H]3CCS(=O)(=O)C3

InChI

InChI=1S/C18H21NO5S/c1-19(13-7-8-25(22,23)11-13)10-16-14-6-4-3-5-12(14)9-15(17(16)20)18(21)24-2/h3-6,9,13,20H,7-8,10-11H2,1-2H3/p+1/t13-/m0/s1