[5-carboxy-2-(phenylsulfanylmethyl)phenyl]-methanidyl-azanium

Systemtic Name: [5-carboxy-2-(phenylsulfanylmethyl)phenyl]-methanidyl-azanium Openeye Name: [5-carboxy-2-(phenylsulfanylmethyl)phenyl]-methanidyl-ammonium CAS Name: [5-carboxy-2-[(phenylthio)methyl]phenyl]-methanidylammonium IUPAC Name: [5-carboxy-2-(phenylsulfanylmethyl)phenyl]-methanidylazanium Traditional Name: [5-carboxy-2-[(phenylthio)methyl]phenyl]-methanidyl-ammonium Formula: C15H15NO2S MolecularWeight: 273.3501

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Descriptors Computed from Structure

Canonical SMILES:

[CH2-][NH2+]C1=C(C=CC(=C1)C(=O)O)CSC2=CC=CC=C2

Isomeric SMILES

[CH2-][NH2+]C1=C(C=CC(=C1)C(=O)O)CSC2=CC=CC=C2

InChI

InChI=1S/C15H15NO2S/c1-16-14-9-11(15(17)18)7-8-12(14)10-19-13-5-3-2-4-6-13/h2-9H,1,10,16H2,(H,17,18)