1-phenyl-2-(phenylmethoxycarbonylamino)ethanesulfonic acid

Systemtic Name: 1-phenyl-2-(phenylmethoxycarbonylamino)ethanesulfonic acid Openeye Name: 2-(benzyloxycarbonylamino)-1-phenyl-ethanesulfonic acid CAS Name: 1-phenyl-2-(phenylmethoxycarbonylamino)ethanesulfonic acid IUPAC Name: 1-phenyl-2-(phenylmethoxycarbonylamino)ethanesulfonic acid Traditional Name: 2-(benzyloxycarbonylamino)-1-phenyl-ethanesulfonic acid Formula: C16H17NO5S MolecularWeight: 335.37488

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)NCC(C2=CC=CC=C2)S(=O)(=O)O

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)NCC(C2=CC=CC=C2)S(=O)(=O)O

InChI

InChI=1S/C16H17NO5S/c18-16(22-12-13-7-3-1-4-8-13)17-11-15(23(19,20)21)14-9-5-2-6-10-14/h1-10,15H,11-12H2,(H,17,18)(H,19,20,21)