methyl (E)-3-azido-3-[6-[[(E)-1-azido-2-cyano-3-methoxy-3-oxidanylidene-prop-1-enyl]amino]hexylamino]-2-cyano-prop-2-enoate

Systemtic Name: methyl (E)-3-azido-3-[6-[[(E)-1-azido-2-cyano-3-methoxy-3-oxidanylidene-prop-1-enyl]amino]hexylamino]-2-cyano-prop-2-enoate Openeye Name: methyl (E)-3-azido-3-[6-[[(E)-1-azido-2-cyano-3-methoxy-3-oxo-prop-1-enyl]amino]hexylamino]-2-cyano-prop-2-enoate CAS Name: (E)-3-azido-3-[6-[[(E)-1-azido-2-cyano-3-methoxy-3-oxoprop-1-enyl]amino]hexylamino]-2-cyano-2-propenoic acid methyl ester IUPAC Name: methyl (E)-3-azido-3-[6-[[(E)-1-azido-2-cyano-3-methoxy-3-oxoprop-1-enyl]amino]hexylamino]-2-cyanoprop-2-enoate Traditional Name: (E)-3-azido-3-[6-[[(E)-1-azido-2-cyano-3-keto-3-methoxy-prop-1-enyl]amino]hexylamino]-2-cyano-acrylic acid methyl ester Formula: C16H20N10O4 MolecularWeight: 416.3946

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H20N10O4/c1-29-15(27)11(9-17)13(23-25-19)21-7-5-3-4-6-8-22-14(24-26-20)12(10-18)16(28)30-2/h21-22H,3-8H2,1-2H3/b13-11+,14-12+