ethyl (E,2R,5R)-2-butyl-5-[(2-methylpropan-2-yl)oxycarbonylamino]hex-3-enoate

Systemtic Name: ethyl (E,2R,5R)-2-butyl-5-[(2-methylpropan-2-yl)oxycarbonylamino]hex-3-enoate Openeye Name: ethyl (E,2R,5R)-5-(tert-butoxycarbonylamino)-2-butyl-hex-3-enoate CAS Name: (E,2R,5R)-2-butyl-5-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-3-hexenoic acid ethyl ester IUPAC Name: ethyl (E,2R,5R)-2-butyl-5-[(2-methylpropan-2-yl)oxycarbonylamino]hex-3-enoate Traditional Name: (E,2R,5R)-5-(tert-butoxycarbonylamino)-2-butyl-hex-3-enoic acid ethyl ester Formula: C17H31NO4 MolecularWeight: 313.43234

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C=CC(C)NC(=O)OC(C)(C)C)C(=O)OCC

Isomeric SMILES

CCCC[C@H](/C=C/[C@@H](C)NC(=O)OC(C)(C)C)C(=O)OCC

InChI

InChI=1S/C17H31NO4/c1-7-9-10-14(15(19)21-8-2)12-11-13(3)18-16(20)22-17(4,5)6/h11-14H,7-10H2,1-6H3,(H,18,20)/b12-11+/t13-,14-/m1/s1