(E)-5-azanyl-6-[(1-methoxy-1-oxidanylidene-3-phenyl-propan-2-yl)-phenylmethoxycarbonyl-amino]-2-oxidanyl-6-oxidanylidene-hex-1-ene-1-diazonium

Systemtic Name: (E)-5-azanyl-6-[(1-methoxy-1-oxidanylidene-3-phenyl-propan-2-yl)-phenylmethoxycarbonyl-amino]-2-oxidanyl-6-oxidanylidene-hex-1-ene-1-diazonium Openeye Name: (E)-5-amino-6-[(1-benzyl-2-methoxy-2-oxo-ethyl)-benzyloxycarbonyl-amino]-2-hydroxy-6-oxo-hex-1-ene-1-diazonium CAS Name: (E)-5-amino-2-hydroxy-6-[(1-methoxy-1-oxo-3-phenylpropan-2-yl)-phenylmethoxycarbonylamino]-6-oxo-1-hexene-1-diazonium IUPAC Name: (E)-5-amino-2-hydroxy-6-[(1-methoxy-1-oxo-3-phenylpropan-2-yl)-phenylmethoxycarbonylamino]-6-oxohex-1-ene-1-diazonium Traditional Name: (E)-5-amino-6-[(1-benzyl-2-keto-2-methoxy-ethyl)-carbobenzoxy-amino]-2-hydroxy-6-keto-hex-1-ene-1-diazonium Formula: C24H27N4O6+ MolecularWeight: 467.49438

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC=CC=C1)N(C(=O)C(CCC(=C[N+]#N)O)N)C(=O)OCC2=CC=CC=C2

Isomeric SMILES

COC(=O)C(CC1=CC=CC=C1)N(C(=O)C(CC/C(=C\[N+]#N)/O)N)C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C24H26N4O6/c1-33-23(31)21(14-17-8-4-2-5-9-17)28(22(30)20(25)13-12-19(29)15-27-26)24(32)34-16-18-10-6-3-7-11-18/h2-11,15,20-21H,12-14,16,25H2,1H3/p+1/b19-15+