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

Systemtic Name: (4-methylphenyl)methyl 5-chloranyl-2-nitro-benzoate Openeye Name: p-tolylmethyl 5-chloro-2-nitro-benzoate CAS Name: 5-chloro-2-nitrobenzoic acid (4-methylphenyl)methyl ester IUPAC Name: (4-methylphenyl)methyl 5-chloro-2-nitrobenzoate Traditional Name: 5-chloro-2-nitro-benzoic acid (4-methylbenzyl) ester Formula: C15H12ClNO4 MolecularWeight: 305.71308

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)COC(=O)C2=C(C=CC(=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)COC(=O)C2=C(C=CC(=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C15H12ClNO4/c1-10-2-4-11(5-3-10)9-21-15(18)13-8-12(16)6-7-14(13)17(19)20/h2-8H,9H2,1H3