2-[(3-methoxyphenyl)-(phenylmethyl)amino]ethanesulfonic acid

Systemtic Name: 2-[(3-methoxyphenyl)-(phenylmethyl)amino]ethanesulfonic acid Openeye Name: 2-(N-benzyl-3-methoxy-anilino)ethanesulfonic acid CAS Name: 2-(3-methoxy-N-(phenylmethyl)anilino)ethanesulfonic acid IUPAC Name: 2-(N-benzyl-3-methoxyanilino)ethanesulfonic acid Traditional Name: 2-(N-benzyl-3-methoxy-anilino)ethanesulfonic acid Formula: C16H19NO4S MolecularWeight: 321.39136

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N(CCS(=O)(=O)O)CC2=CC=CC=C2

Isomeric SMILES

COC1=CC=CC(=C1)N(CCS(=O)(=O)O)CC2=CC=CC=C2

InChI

InChI=1S/C16H19NO4S/c1-21-16-9-5-8-15(12-16)17(10-11-22(18,19)20)13-14-6-3-2-4-7-14/h2-9,12H,10-11,13H2,1H3,(H,18,19,20)