3-acetamido-3-azanyl-6-phenyl-cyclohexa-1,4-diene-1-sulfonic acid

Systemtic Name: 3-acetamido-3-azanyl-6-phenyl-cyclohexa-1,4-diene-1-sulfonic acid Openeye Name: 3-acetamido-3-amino-6-phenyl-cyclohexa-1,4-diene-1-sulfonic acid CAS Name: 3-acetamido-3-amino-6-phenyl-1-cyclohexa-1,4-dienesulfonic acid IUPAC Name: 3-acetamido-3-amino-6-phenylcyclohexa-1,4-diene-1-sulfonic acid Traditional Name: 3-acetamido-3-amino-6-phenyl-cyclohexa-1,4-diene-1-sulfonic acid Formula: C14H16N2O4S MolecularWeight: 308.35284

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1(C=CC(C(=C1)S(=O)(=O)O)C2=CC=CC=C2)N

Isomeric SMILES

CC(=O)NC1(C=CC(C(=C1)S(=O)(=O)O)C2=CC=CC=C2)N

InChI

InChI=1S/C14H16N2O4S/c1-10(17)16-14(15)8-7-12(11-5-3-2-4-6-11)13(9-14)21(18,19)20/h2-9,12H,15H2,1H3,(H,16,17)(H,18,19,20)