(phenylmethyl) (E,5S)-5-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxidanylidene-hex-2-enoate

Systemtic Name: (phenylmethyl) (E,5S)-5-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxidanylidene-hex-2-enoate Openeye Name: benzyl (E,5S)-5-(tert-butoxycarbonylamino)-4-oxo-hex-2-enoate CAS Name: (E,5S)-5-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-4-oxo-2-hexenoic acid (phenylmethyl) ester IUPAC Name: benzyl (E,5S)-5-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxohex-2-enoate Traditional Name: (E,5S)-5-(tert-butoxycarbonylamino)-4-keto-hex-2-enoic acid benzyl ester Formula: C18H23NO5 MolecularWeight: 333.37892

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H23NO5/c1-13(19-17(22)24-18(2,3)4)15(20)10-11-16(21)23-12-14-8-6-5-7-9-14/h5-11,13H,12H2,1-4H3,(H,19,22)/b11-10+/t13-/m0/s1