carboxy-methoxycarbonylsulfanyl-methyl-phenyl-azanium

Systemtic Name: carboxy-methoxycarbonylsulfanyl-methyl-phenyl-azanium Openeye Name: carboxy-methoxycarbonylsulfanyl-methyl-phenyl-ammonium CAS Name: carboxy-(methoxycarbonylthio)-methyl-phenylammonium IUPAC Name: carboxy-methoxycarbonylsulfanyl-methyl-phenylazanium Traditional Name: (carbomethoxythio)-carboxy-methyl-phenyl-ammonium Formula: C10H12NO4S+ MolecularWeight: 242.27158

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C1=CC=CC=C1)(C(=O)O)SC(=O)OC

Isomeric SMILES

C[N+](C1=CC=CC=C1)(C(=O)O)SC(=O)OC

InChI

InChI=1S/C10H11NO4S/c1-11(9(12)13,16-10(14)15-2)8-6-4-3-5-7-8/h3-7H,1-2H3/p+1