4-methyl-3-[5-[(2-methylpropan-2-yl)oxycarbonylamino]pentyl]benzenesulfonate

Systemtic Name: 4-methyl-3-[5-[(2-methylpropan-2-yl)oxycarbonylamino]pentyl]benzenesulfonate Openeye Name: 3-[5-(tert-butoxycarbonylamino)pentyl]-4-methyl-benzenesulfonate CAS Name: 4-methyl-3-[5-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]pentyl]benzenesulfonate IUPAC Name: 4-methyl-3-[5-[(2-methylpropan-2-yl)oxycarbonylamino]pentyl]benzenesulfonate Traditional Name: 3-[5-(tert-butoxycarbonylamino)pentyl]-4-methyl-besylate Formula: C17H26NO5S- MolecularWeight: 356.45704

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)[O-])CCCCCNC(=O)OC(C)(C)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)[O-])CCCCCNC(=O)OC(C)(C)C

InChI

InChI=1S/C17H27NO5S/c1-13-9-10-15(24(20,21)22)12-14(13)8-6-5-7-11-18-16(19)23-17(2,3)4/h9-10,12H,5-8,11H2,1-4H3,(H,18,19)(H,20,21,22)/p-1