3-[4-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl]propane-1-sulfonic acid

Systemtic Name: 3-[4-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl]propane-1-sulfonic acid Openeye Name: 3-[4-(tert-butoxycarbonylamino)phenyl]propane-1-sulfonic acid CAS Name: 3-[4-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]phenyl]-1-propanesulfonic acid IUPAC Name: 3-[4-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl]propane-1-sulfonic acid Traditional Name: 3-[4-(tert-butoxycarbonylamino)phenyl]propane-1-sulfonic acid Formula: C14H21NO5S MolecularWeight: 315.38524

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1=CC=C(C=C1)CCCS(=O)(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)NC1=CC=C(C=C1)CCCS(=O)(=O)O

InChI

InChI=1S/C14H21NO5S/c1-14(2,3)20-13(16)15-12-8-6-11(7-9-12)5-4-10-21(17,18)19/h6-9H,4-5,10H2,1-3H3,(H,15,16)(H,17,18,19)