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

Systemtic Name: (3-methylphenyl)methyl 2-chloranyl-4-nitro-benzoate Openeye Name: m-tolylmethyl 2-chloro-4-nitro-benzoate CAS Name: 2-chloro-4-nitrobenzoic acid (3-methylphenyl)methyl ester IUPAC Name: (3-methylphenyl)methyl 2-chloro-4-nitrobenzoate Traditional Name: 2-chloro-4-nitro-benzoic acid (3-methylbenzyl) ester Formula: C15H12ClNO4 MolecularWeight: 305.71308

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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