[5-[(E)-2-cyano-3-(diethylamino)-3-oxidanylidene-prop-1-enyl]-3-nitro-2-oxidanyl-phenyl] N-ethylcarbamate

Systemtic Name: [5-[(E)-2-cyano-3-(diethylamino)-3-oxidanylidene-prop-1-enyl]-3-nitro-2-oxidanyl-phenyl] N-ethylcarbamate Openeye Name: [5-[(E)-2-cyano-3-(diethylamino)-3-oxo-prop-1-enyl]-2-hydroxy-3-nitro-phenyl] N-ethylcarbamate CAS Name: N-ethylcarbamic acid [5-[(E)-2-cyano-3-(diethylamino)-3-oxoprop-1-enyl]-2-hydroxy-3-nitrophenyl] ester IUPAC Name: [5-[(E)-2-cyano-3-(diethylamino)-3-oxoprop-1-enyl]-2-hydroxy-3-nitrophenyl] N-ethylcarbamate Traditional Name: N-ethylcarbamic acid [5-[(E)-2-cyano-3-(diethylamino)-3-keto-prop-1-enyl]-2-hydroxy-3-nitro-phenyl] ester Formula: C17H20N4O6 MolecularWeight: 376.3639

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)OC1=CC(=CC(=C1O)[N+](=O)[O-])C=C(C#N)C(=O)N(CC)CC

Isomeric SMILES

CCNC(=O)OC1=CC(=CC(=C1O)[N+](=O)[O-])/C=C(\C#N)/C(=O)N(CC)CC

InChI

InChI=1S/C17H20N4O6/c1-4-19-17(24)27-14-9-11(8-13(15(14)22)21(25)26)7-12(10-18)16(23)20(5-2)6-3/h7-9,22H,4-6H2,1-3H3,(H,19,24)/b12-7+