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ethyl 3-[[4-(2,2-diisocyanoethenyl)phenyl]-ethyl-amino]propanoate

ethyl 3-[[4-(2,2-diisocyanoethenyl)phenyl]-ethyl-amino]propanoate

Systemtic Name:ethyl 3-[[4-(2,2-diisocyanoethenyl)phenyl]-ethyl-amino]propanoate
Openeye Name:ethyl 3-[4-(2,2-diisocyanovinyl)-N-ethyl-anilino]propanoate
CAS Name:3-[4-(2,2-diisocyanoethenyl)-N-ethylanilino]propanoic acid ethyl ester
IUPAC Name:ethyl 3-[4-(2,2-diisocyanoethenyl)-N-ethylanilino]propanoate
Traditional Name:3-[4-(2,2-diisocyanovinyl)-N-ethyl-anilino]propionic acid ethyl ester
Formula: C17H19N3O2
MolecularWeight: 297.35166
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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCC(=O)OCC)C1=CC=C(C=C1)C=C([N+]#[C-])[N+]#[C-]


Isomeric SMILES

CCN(CCC(=O)OCC)C1=CC=C(C=C1)C=C([N+]#[C-])[N+]#[C-]


InChI

InChI=1S/C17H19N3O2/c1-5-20(12-11-17(21)22-6-2)15-9-7-14(8-10-15)13-16(18-3)19-4/h7-10,13H,5-6,11-12H2,1-2H3


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