2-(dimethylaminomethylideneamino)-4-ethoxy-5-nitro-benzoic acid

Systemtic Name: 2-(dimethylaminomethylideneamino)-4-ethoxy-5-nitro-benzoic acid Openeye Name: 2-(dimethylaminomethyleneamino)-4-ethoxy-5-nitro-benzoic acid CAS Name: 2-(dimethylaminomethylideneamino)-4-ethoxy-5-nitrobenzoic acid IUPAC Name: 2-(dimethylaminomethylideneamino)-4-ethoxy-5-nitrobenzoic acid Traditional Name: 2-(dimethylaminomethyleneamino)-4-ethoxy-5-nitro-benzoic acid Formula: C12H15N3O5 MolecularWeight: 281.2646

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C(=C1)N=CN(C)C)C(=O)O)[N+](=O)[O-]

Isomeric SMILES

CCOC1=C(C=C(C(=C1)N=CN(C)C)C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C12H15N3O5/c1-4-20-11-6-9(13-7-14(2)3)8(12(16)17)5-10(11)15(18)19/h5-7H,4H2,1-3H3,(H,16,17)