3-azanyl-4-(2-carboxylatophenyl)sulfanyl-benzoate

Systemtic Name: 3-azanyl-4-(2-carboxylatophenyl)sulfanyl-benzoate Openeye Name: 3-amino-4-(2-carboxylatophenyl)sulfanyl-benzoate CAS Name: 3-amino-4-[(2-carboxylatophenyl)thio]benzoate IUPAC Name: 3-amino-4-(2-carboxylatophenyl)sulfanylbenzoate Traditional Name: 3-amino-4-[(2-carboxylatophenyl)thio]benzoate Formula: C14H9NO4S-2 MolecularWeight: 287.29056

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)[O-])SC2=C(C=C(C=C2)C(=O)[O-])N

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)[O-])SC2=C(C=C(C=C2)C(=O)[O-])N

InChI

InChI=1S/C14H11NO4S/c15-10-7-8(13(16)17)5-6-12(10)20-11-4-2-1-3-9(11)14(18)19/h1-7H,15H2,(H,16,17)(H,18,19)/p-2