methyl 2-[4-[[2-(diethylamino)-2-oxidanylidene-ethyl]-methyl-amino]-3-nitro-phenyl]carbonylbenzoate

Systemtic Name: methyl 2-[4-[[2-(diethylamino)-2-oxidanylidene-ethyl]-methyl-amino]-3-nitro-phenyl]carbonylbenzoate Openeye Name: methyl 2-[4-[[2-(diethylamino)-2-oxo-ethyl]-methyl-amino]-3-nitro-benzoyl]benzoate CAS Name: 2-[[4-[[2-(diethylamino)-2-oxoethyl]-methylamino]-3-nitrophenyl]-oxomethyl]benzoic acid methyl ester IUPAC Name: methyl 2-[4-[[2-(diethylamino)-2-oxoethyl]-methylamino]-3-nitrobenzoyl]benzoate Traditional Name: 2-[4-[[2-(diethylamino)-2-keto-ethyl]-methyl-amino]-3-nitro-benzoyl]benzoic acid methyl ester Formula: C22H25N3O6 MolecularWeight: 427.4504

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)CN(C)C1=C(C=C(C=C1)C(=O)C2=CC=CC=C2C(=O)OC)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)C(=O)CN(C)C1=C(C=C(C=C1)C(=O)C2=CC=CC=C2C(=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C22H25N3O6/c1-5-24(6-2)20(26)14-23(3)18-12-11-15(13-19(18)25(29)30)21(27)16-9-7-8-10-17(16)22(28)31-4/h7-13H,5-6,14H2,1-4H3