2-[(3-acetamidophenyl)-ethyl-amino]ethyl hydrogen sulfate

Systemtic Name: 2-[(3-acetamidophenyl)-ethyl-amino]ethyl hydrogen sulfate Openeye Name: 2-(3-acetamido-N-ethyl-anilino)ethyl hydrogen sulfate CAS Name: sulfuric acid 2-(3-acetamido-N-ethylanilino)ethyl ester IUPAC Name: 2-(3-acetamido-N-ethylanilino)ethyl hydrogen sulfate Traditional Name: sulfuric acid 2-(3-acetamido-N-ethyl-anilino)ethyl ester Formula: C12H18N2O5S MolecularWeight: 302.34672

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCOS(=O)(=O)O)C1=CC=CC(=C1)NC(=O)C

Isomeric SMILES

CCN(CCOS(=O)(=O)O)C1=CC=CC(=C1)NC(=O)C

InChI

InChI=1S/C12H18N2O5S/c1-3-14(7-8-19-20(16,17)18)12-6-4-5-11(9-12)13-10(2)15/h4-6,9H,3,7-8H2,1-2H3,(H,13,15)(H,16,17,18)