2-[(5-formamido-2-methoxy-phenyl)-(phenylmethyl)amino]ethanesulfonic acid

Systemtic Name: 2-[(5-formamido-2-methoxy-phenyl)-(phenylmethyl)amino]ethanesulfonic acid Openeye Name: 2-(N-benzyl-5-formamido-2-methoxy-anilino)ethanesulfonic acid CAS Name: 2-(5-formamido-2-methoxy-N-(phenylmethyl)anilino)ethanesulfonic acid IUPAC Name: 2-(N-benzyl-5-formamido-2-methoxyanilino)ethanesulfonic acid Traditional Name: 2-(N-benzyl-5-formamido-2-methoxy-anilino)ethanesulfonic acid Formula: C17H20N2O5S MolecularWeight: 364.4161

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H20N2O5S/c1-24-17-8-7-15(18-13-20)11-16(17)19(9-10-25(21,22)23)12-14-5-3-2-4-6-14/h2-8,11,13H,9-10,12H2,1H3,(H,18,20)(H,21,22,23)