decyl 2-azanyl-3-bromanyl-5-nitro-benzoate

Systemtic Name: decyl 2-azanyl-3-bromanyl-5-nitro-benzoate Openeye Name: decyl 2-amino-3-bromo-5-nitro-benzoate CAS Name: 2-amino-3-bromo-5-nitrobenzoic acid decyl ester IUPAC Name: decyl 2-amino-3-bromo-5-nitrobenzoate Traditional Name: 2-amino-3-bromo-5-nitro-benzoic acid decyl ester Formula: C17H25BrN2O4 MolecularWeight: 401.2954

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC(=O)C1=CC(=CC(=C1N)Br)[N+](=O)[O-]

Isomeric SMILES

CCCCCCCCCCOC(=O)C1=CC(=CC(=C1N)Br)[N+](=O)[O-]

InChI

InChI=1S/C17H25BrN2O4/c1-2-3-4-5-6-7-8-9-10-24-17(21)14-11-13(20(22)23)12-15(18)16(14)19/h11-12H,2-10,19H2,1H3