ethyl 2-[[(Z)-2-cyano-3-(2-nitrophenyl)prop-2-enyl]-ethoxycarbonyl-amino]ethanoate

Systemtic Name: ethyl 2-[[(Z)-2-cyano-3-(2-nitrophenyl)prop-2-enyl]-ethoxycarbonyl-amino]ethanoate Openeye Name: ethyl 2-[[(Z)-2-cyano-3-(2-nitrophenyl)allyl]-ethoxycarbonyl-amino]acetate CAS Name: 2-[[(Z)-2-cyano-3-(2-nitrophenyl)prop-2-enyl]-ethoxycarbonylamino]acetic acid ethyl ester IUPAC Name: ethyl 2-[[(Z)-2-cyano-3-(2-nitrophenyl)prop-2-enyl]-ethoxycarbonylamino]acetate Traditional Name: 2-[carbethoxy-[(Z)-2-cyano-3-(2-nitrophenyl)allyl]amino]acetic acid ethyl ester Formula: C17H19N3O6 MolecularWeight: 361.34926

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN(CC(=CC1=CC=CC=C1[N+](=O)[O-])C#N)C(=O)OCC

Isomeric SMILES

CCOC(=O)CN(C/C(=C/C1=CC=CC=C1[N+](=O)[O-])/C#N)C(=O)OCC

InChI

InChI=1S/C17H19N3O6/c1-3-25-16(21)12-19(17(22)26-4-2)11-13(10-18)9-14-7-5-6-8-15(14)20(23)24/h5-9H,3-4,11-12H2,1-2H3/b13-9+