3-azanyl-1-oxidanylidene-1-phenylazanyl-propane-2-sulfonic acid

Systemtic Name: 3-azanyl-1-oxidanylidene-1-phenylazanyl-propane-2-sulfonic acid Openeye Name: 3-amino-1-anilino-1-oxo-propane-2-sulfonic acid CAS Name: 3-amino-1-anilino-1-oxo-2-propanesulfonic acid IUPAC Name: 3-amino-1-anilino-1-oxopropane-2-sulfonic acid Traditional Name: 3-amino-1-anilino-1-keto-propane-2-sulfonic acid Formula: C9H12N2O4S MolecularWeight: 244.26758

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)C(CN)S(=O)(=O)O

Isomeric SMILES

C1=CC=C(C=C1)NC(=O)C(CN)S(=O)(=O)O

InChI

InChI=1S/C9H12N2O4S/c10-6-8(16(13,14)15)9(12)11-7-4-2-1-3-5-7/h1-5,8H,6,10H2,(H,11,12)(H,13,14,15)