methyl 2-[[2-cyano-1-(4-nitrophenyl)prop-2-enyl]amino]ethanoate

Systemtic Name: methyl 2-[[2-cyano-1-(4-nitrophenyl)prop-2-enyl]amino]ethanoate Openeye Name: methyl 2-[[2-cyano-1-(4-nitrophenyl)allyl]amino]acetate CAS Name: 2-[[2-cyano-1-(4-nitrophenyl)prop-2-enyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[[2-cyano-1-(4-nitrophenyl)prop-2-enyl]amino]acetate Traditional Name: 2-[[2-cyano-1-(4-nitrophenyl)allyl]amino]acetic acid methyl ester Formula: C13H13N3O4 MolecularWeight: 275.26002

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CNC(C1=CC=C(C=C1)[N+](=O)[O-])C(=C)C#N

Isomeric SMILES

COC(=O)CNC(C1=CC=C(C=C1)[N+](=O)[O-])C(=C)C#N

InChI

InChI=1S/C13H13N3O4/c1-9(7-14)13(15-8-12(17)20-2)10-3-5-11(6-4-10)16(18)19/h3-6,13,15H,1,8H2,2H3