[2-acetyloxy-5-[(E)-2-cyano-3-(diethylamino)-3-oxidanylidene-prop-1-enyl]-3-nitro-phenyl] ethanoate

Systemtic Name: [2-acetyloxy-5-[(E)-2-cyano-3-(diethylamino)-3-oxidanylidene-prop-1-enyl]-3-nitro-phenyl] ethanoate Openeye Name: [2-acetoxy-5-[(E)-2-cyano-3-(diethylamino)-3-oxo-prop-1-enyl]-3-nitro-phenyl] acetate CAS Name: acetic acid [2-acetyloxy-5-[(E)-2-cyano-3-(diethylamino)-3-oxoprop-1-enyl]-3-nitrophenyl] ester IUPAC Name: [2-acetyloxy-5-[(E)-2-cyano-3-(diethylamino)-3-oxoprop-1-enyl]-3-nitrophenyl] acetate Traditional Name: acetic acid [2-acetoxy-5-[(E)-2-cyano-3-(diethylamino)-3-keto-prop-1-enyl]-3-nitro-phenyl] ester Formula: C18H19N3O7 MolecularWeight: 389.35936

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C(=CC1=CC(=C(C(=C1)OC(=O)C)OC(=O)C)[N+](=O)[O-])C#N

Isomeric SMILES

CCN(CC)C(=O)/C(=C/C1=CC(=C(C(=C1)OC(=O)C)OC(=O)C)[N+](=O)[O-])/C#N

InChI

InChI=1S/C18H19N3O7/c1-5-20(6-2)18(24)14(10-19)7-13-8-15(21(25)26)17(28-12(4)23)16(9-13)27-11(3)22/h7-9H,5-6H2,1-4H3/b14-7+