2-(3-methoxypropanoylamino)-3-phenyl-benzenesulfonic acid

Systemtic Name: 2-(3-methoxypropanoylamino)-3-phenyl-benzenesulfonic acid Openeye Name: 2-(3-methoxypropanoylamino)-3-phenyl-benzenesulfonic acid CAS Name: 2-[(3-methoxy-1-oxopropyl)amino]-3-phenylbenzenesulfonic acid IUPAC Name: 2-(3-methoxypropanoylamino)-3-phenylbenzenesulfonic acid Traditional Name: 2-(3-methoxypropanoylamino)-3-phenyl-besylic acid Formula: C16H17NO5S MolecularWeight: 335.37488

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Descriptors Computed from Structure

Canonical SMILES:

COCCC(=O)NC1=C(C=CC=C1S(=O)(=O)O)C2=CC=CC=C2

Isomeric SMILES

COCCC(=O)NC1=C(C=CC=C1S(=O)(=O)O)C2=CC=CC=C2

InChI

InChI=1S/C16H17NO5S/c1-22-11-10-15(18)17-16-13(12-6-3-2-4-7-12)8-5-9-14(16)23(19,20)21/h2-9H,10-11H2,1H3,(H,17,18)(H,19,20,21)