(4-chloranylnaphthalen-1-yl) 3,5-dinitrobenzoate

Systemtic Name: (4-chloranylnaphthalen-1-yl) 3,5-dinitrobenzoate Openeye Name: (4-chloro-1-naphthyl) 3,5-dinitrobenzoate CAS Name: 3,5-dinitrobenzoic acid (4-chloro-1-naphthalenyl) ester IUPAC Name: (4-chloronaphthalen-1-yl) 3,5-dinitrobenzoate Traditional Name: 3,5-dinitrobenzoic acid (4-chloro-1-naphthyl) ester Formula: C17H9ClN2O6 MolecularWeight: 372.71616

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC=C2Cl)OC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC=C2Cl)OC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C17H9ClN2O6/c18-15-5-6-16(14-4-2-1-3-13(14)15)26-17(21)10-7-11(19(22)23)9-12(8-10)20(24)25/h1-9H