2-dimethylaminoethyl 3,5-dinitrobenzoate

Systemtic Name: 2-dimethylaminoethyl 3,5-dinitrobenzoate Openeye Name: 2-dimethylaminoethyl 3,5-dinitrobenzoate CAS Name: 3,5-dinitrobenzoic acid 2-dimethylaminoethyl ester IUPAC Name: 2-dimethylaminoethyl 3,5-dinitrobenzoate Traditional Name: 3,5-dinitrobenzoic acid 2-dimethylaminoethyl ester Formula: C11H13N3O6 MolecularWeight: 283.23742

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H13N3O6/c1-12(2)3-4-20-11(15)8-5-9(13(16)17)7-10(6-8)14(18)19/h5-7H,3-4H2,1-2H3