methyl (E)-3-azido-2-cyano-3-[(1-methoxy-3-oxidanyl-1-oxidanylidene-propan-2-yl)amino]prop-2-enoate

Systemtic Name: methyl (E)-3-azido-2-cyano-3-[(1-methoxy-3-oxidanyl-1-oxidanylidene-propan-2-yl)amino]prop-2-enoate Openeye Name: methyl (E)-3-azido-2-cyano-3-[[1-(hydroxymethyl)-2-methoxy-2-oxo-ethyl]amino]prop-2-enoate CAS Name: (E)-3-azido-2-cyano-3-[(3-hydroxy-1-methoxy-1-oxopropan-2-yl)amino]-2-propenoic acid methyl ester IUPAC Name: methyl (E)-3-azido-2-cyano-3-[(3-hydroxy-1-methoxy-1-oxopropan-2-yl)amino]prop-2-enoate Traditional Name: (E)-3-azido-2-cyano-3-[(2-keto-2-methoxy-1-methylol-ethyl)amino]acrylic acid methyl ester Formula: C9H11N5O5 MolecularWeight: 269.21414

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CO)NC(=C(C#N)C(=O)OC)N=[N+]=[N-]

Isomeric SMILES

COC(=O)C(CO)N/C(=C(/C#N)\C(=O)OC)/N=[N+]=[N-]

InChI

InChI=1S/C9H11N5O5/c1-18-8(16)5(3-10)7(13-14-11)12-6(4-15)9(17)19-2/h6,12,15H,4H2,1-2H3/b7-5+