3-[(4-aminophenyl)amino]-3-oxidanylidene-propane-1-sulfonic acid

Systemtic Name: 3-[(4-aminophenyl)amino]-3-oxidanylidene-propane-1-sulfonic acid Openeye Name: 3-(4-aminoanilino)-3-oxo-propane-1-sulfonic acid CAS Name: 3-(4-aminoanilino)-3-oxo-1-propanesulfonic acid IUPAC Name: 3-(4-aminoanilino)-3-oxopropane-1-sulfonic acid Traditional Name: 3-(4-aminoanilino)-3-keto-propane-1-sulfonic acid Formula: C9H12N2O4S MolecularWeight: 244.26758

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1N)NC(=O)CCS(=O)(=O)O

Isomeric SMILES

C1=CC(=CC=C1N)NC(=O)CCS(=O)(=O)O

InChI

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