N-[(4S)-5-oxidanyl-5-oxidanylidene-4-(phenylmethoxycarbonylamino)pentyl]-1-phenyl-methanimine oxide

Systemtic Name: N-[(4S)-5-oxidanyl-5-oxidanylidene-4-(phenylmethoxycarbonylamino)pentyl]-1-phenyl-methanimine oxide Openeye Name: N-[(4S)-4-(benzyloxycarbonylamino)-5-hydroxy-5-oxo-pentyl]-1-phenyl-methanimine oxide CAS Name: N-[(4S)-5-hydroxy-5-oxo-4-(phenylmethoxycarbonylamino)pentyl]-1-phenylmethanimine oxide IUPAC Name: N-[(4S)-5-hydroxy-5-oxo-4-(phenylmethoxycarbonylamino)pentyl]-1-phenylmethanimine oxide Traditional Name: N-[(4S)-4-(benzyloxycarbonylamino)-5-hydroxy-5-keto-pentyl]-1-phenyl-methanimine oxide Formula: C20H22N2O5 MolecularWeight: 370.39908

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)NC(CCC[N+](=CC2=CC=CC=C2)[O-])C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)N[C@@H](CCC/[N+](=C\C2=CC=CC=C2)/[O-])C(=O)O

InChI

InChI=1S/C20H22N2O5/c23-19(24)18(21-20(25)27-15-17-10-5-2-6-11-17)12-7-13-22(26)14-16-8-3-1-4-9-16/h1-6,8-11,14,18H,7,12-13,15H2,(H,21,25)(H,23,24)/b22-14+/t18-/m0/s1