(E,3S)-2-oxidanyl-3-(phenylmethoxycarbonylamino)-4-(4-phenylmethoxyphenyl)but-1-ene-1-diazonium

Systemtic Name: (E,3S)-2-oxidanyl-3-(phenylmethoxycarbonylamino)-4-(4-phenylmethoxyphenyl)but-1-ene-1-diazonium Openeye Name: (E,3S)-3-(benzyloxycarbonylamino)-4-(4-benzyloxyphenyl)-2-hydroxy-but-1-ene-1-diazonium CAS Name: (E,3S)-2-hydroxy-3-(phenylmethoxycarbonylamino)-4-(4-phenylmethoxyphenyl)-1-butene-1-diazonium IUPAC Name: (E,3S)-2-hydroxy-3-(phenylmethoxycarbonylamino)-4-(4-phenylmethoxyphenyl)but-1-ene-1-diazonium Traditional Name: (E,3S)-4-(4-benzoxyphenyl)-3-(benzyloxycarbonylamino)-2-hydroxy-but-1-ene-1-diazonium Formula: C25H24N3O4+ MolecularWeight: 430.47576

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC=C(C=C2)CC(C(=C[N+]#N)O)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC=C(C=C2)C[C@@H](/C(=C\[N+]#N)/O)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C25H23N3O4/c26-27-16-24(29)23(28-25(30)32-18-21-9-5-2-6-10-21)15-19-11-13-22(14-12-19)31-17-20-7-3-1-4-8-20/h1-14,16,23H,15,17-18H2,(H-,28,29,30)/p+1/b24-16+/t23-/m0/s1