4-(phenylmethoxycarbonylamino)butane-1-sulfonic acid

Systemtic Name: 4-(phenylmethoxycarbonylamino)butane-1-sulfonic acid Openeye Name: 4-(benzyloxycarbonylamino)butane-1-sulfonic acid CAS Name: 4-(phenylmethoxycarbonylamino)-1-butanesulfonic acid IUPAC Name: 4-(phenylmethoxycarbonylamino)butane-1-sulfonic acid Traditional Name: 4-(benzyloxycarbonylamino)butane-1-sulfonic acid Formula: C12H17NO5S MolecularWeight: 287.33208

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)NCCCCS(=O)(=O)O

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)NCCCCS(=O)(=O)O

InChI

InChI=1S/C12H17NO5S/c14-12(13-8-4-5-9-19(15,16)17)18-10-11-6-2-1-3-7-11/h1-3,6-7H,4-5,8-10H2,(H,13,14)(H,15,16,17)