(phenylmethyl) (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]hepta-4,5-dienoate

Systemtic Name: (phenylmethyl) (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]hepta-4,5-dienoate Openeye Name: benzyl (2S)-2-(tert-butoxycarbonylamino)hepta-4,5-dienoate CAS Name: (2S)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]hepta-4,5-dienoic acid (phenylmethyl) ester IUPAC Name: benzyl (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]hepta-4,5-dienoate Traditional Name: (2S)-2-(tert-butoxycarbonylamino)hepta-4,5-dienoic acid benzyl ester Formula: C19H25NO4 MolecularWeight: 331.4061

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Descriptors Computed from Structure

Canonical SMILES:

CC=C=CCC(C(=O)OCC1=CC=CC=C1)NC(=O)OC(C)(C)C

Isomeric SMILES

CC=C=CC[C@@H](C(=O)OCC1=CC=CC=C1)NC(=O)OC(C)(C)C

InChI

InChI=1S/C19H25NO4/c1-5-6-8-13-16(20-18(22)24-19(2,3)4)17(21)23-14-15-11-9-7-10-12-15/h5,7-12,16H,13-14H2,1-4H3,(H,20,22)/t6?,16-/m0/s1