ethyl 3-[[3-chloranyl-4-[2-(diethylamino)-2-oxidanylidene-ethoxy]phenyl]carbamoyl]-5-nitro-benzoate

Systemtic Name: ethyl 3-[[3-chloranyl-4-[2-(diethylamino)-2-oxidanylidene-ethoxy]phenyl]carbamoyl]-5-nitro-benzoate Openeye Name: ethyl 3-[[3-chloro-4-[2-(diethylamino)-2-oxo-ethoxy]phenyl]carbamoyl]-5-nitro-benzoate CAS Name: 3-[[3-chloro-4-[2-(diethylamino)-2-oxoethoxy]anilino]-oxomethyl]-5-nitrobenzoic acid ethyl ester IUPAC Name: ethyl 3-[[3-chloro-4-[2-(diethylamino)-2-oxoethoxy]phenyl]carbamoyl]-5-nitrobenzoate Traditional Name: 3-[[3-chloro-4-[2-(diethylamino)-2-keto-ethoxy]phenyl]carbamoyl]-5-nitro-benzoic acid ethyl ester Formula: C22H24ClN3O7 MolecularWeight: 477.89486

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)COC1=C(C=C(C=C1)NC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])C(=O)OCC)Cl

Isomeric SMILES

CCN(CC)C(=O)COC1=C(C=C(C=C1)NC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])C(=O)OCC)Cl

InChI

InChI=1S/C22H24ClN3O7/c1-4-25(5-2)20(27)13-33-19-8-7-16(12-18(19)23)24-21(28)14-9-15(22(29)32-6-3)11-17(10-14)26(30)31/h7-12H,4-6,13H2,1-3H3,(H,24,28)