1-phenoxy-3-(phenylmethoxycarbonylamino)propane-2-sulfonic acid

Systemtic Name: 1-phenoxy-3-(phenylmethoxycarbonylamino)propane-2-sulfonic acid Openeye Name: 1-(benzyloxycarbonylamino)-3-phenoxy-propane-2-sulfonic acid CAS Name: 1-phenoxy-3-(phenylmethoxycarbonylamino)-2-propanesulfonic acid IUPAC Name: 1-phenoxy-3-(phenylmethoxycarbonylamino)propane-2-sulfonic acid Traditional Name: 1-(benzyloxycarbonylamino)-3-phenoxy-propane-2-sulfonic acid Formula: C17H19NO6S MolecularWeight: 365.40086

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)NCC(COC2=CC=CC=C2)S(=O)(=O)O

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)NCC(COC2=CC=CC=C2)S(=O)(=O)O

InChI

InChI=1S/C17H19NO6S/c19-17(24-12-14-7-3-1-4-8-14)18-11-16(25(20,21)22)13-23-15-9-5-2-6-10-15/h1-10,16H,11-13H2,(H,18,19)(H,20,21,22)