propan-2-yl (1R,3S)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-1-phenyl-pentane-1-sulfonate

Systemtic Name: propan-2-yl (1R,3S)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-1-phenyl-pentane-1-sulfonate Openeye Name: isopropyl (1R,3S)-3-(tert-butoxycarbonylamino)-1-phenyl-pentane-1-sulfonate CAS Name: (1R,3S)-3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-phenyl-1-pentanesulfonic acid IUPAC Name: propan-2-yl (1R,3S)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-1-phenylpentane-1-sulfonate Traditional Name: (1R,3S)-3-(tert-butoxycarbonylamino)-1-phenyl-pentane-1-sulfonic acid isopropyl ester Formula: C19H31NO5S MolecularWeight: 385.51814

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CC(C1=CC=CC=C1)S(=O)(=O)OC(C)C)NC(=O)OC(C)(C)C

Isomeric SMILES

CC[C@@H](C[C@H](C1=CC=CC=C1)S(=O)(=O)OC(C)C)NC(=O)OC(C)(C)C

InChI

InChI=1S/C19H31NO5S/c1-7-16(20-18(21)24-19(4,5)6)13-17(15-11-9-8-10-12-15)26(22,23)25-14(2)3/h8-12,14,16-17H,7,13H2,1-6H3,(H,20,21)/t16-,17+/m0/s1