(4-cyanophenyl)methyl 2-chloranyl-5-nitro-benzoate

Systemtic Name: (4-cyanophenyl)methyl 2-chloranyl-5-nitro-benzoate Openeye Name: (4-cyanophenyl)methyl 2-chloro-5-nitro-benzoate CAS Name: 2-chloro-5-nitrobenzoic acid (4-cyanophenyl)methyl ester IUPAC Name: (4-cyanophenyl)methyl 2-chloro-5-nitrobenzoate Traditional Name: 2-chloro-5-nitro-benzoic acid (4-cyanobenzyl) ester Formula: C15H9ClN2O4 MolecularWeight: 316.69596

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1COC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])Cl)C#N

Isomeric SMILES

C1=CC(=CC=C1COC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])Cl)C#N

InChI

InChI=1S/C15H9ClN2O4/c16-14-6-5-12(18(20)21)7-13(14)15(19)22-9-11-3-1-10(8-17)2-4-11/h1-7H,9H2