(2S,3R)-3-ethenyl-3,7-dimethyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]oct-6-enoic acid

Systemtic Name: (2S,3R)-3-ethenyl-3,7-dimethyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]oct-6-enoic acid Openeye Name: (2S,3R)-2-(tert-butoxycarbonylamino)-3,7-dimethyl-3-vinyl-oct-6-enoic acid CAS Name: (2S,3R)-3-ethenyl-3,7-dimethyl-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-6-octenoic acid IUPAC Name: (2S,3R)-3-ethenyl-3,7-dimethyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]oct-6-enoic acid Traditional Name: (2S,3R)-2-(tert-butoxycarbonylamino)-3,7-dimethyl-3-vinyl-oct-6-enoic acid Formula: C17H29NO4 MolecularWeight: 311.41646

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=CCCC(C)(C=C)C(C(=O)O)NC(=O)OC(C)(C)C)C

Isomeric SMILES

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

InChI

InChI=1S/C17H29NO4/c1-8-17(7,11-9-10-12(2)3)13(14(19)20)18-15(21)22-16(4,5)6/h8,10,13H,1,9,11H2,2-7H3,(H,18,21)(H,19,20)/t13-,17+/m1/s1