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

Systemtic Name: (3-methylphenyl)methyl 2-chloranyl-5-nitro-benzoate Openeye Name: m-tolylmethyl 2-chloro-5-nitro-benzoate CAS Name: 2-chloro-5-nitrobenzoic acid (3-methylphenyl)methyl ester IUPAC Name: (3-methylphenyl)methyl 2-chloro-5-nitrobenzoate Traditional Name: 2-chloro-5-nitro-benzoic acid (3-methylbenzyl) ester Formula: C15H12ClNO4 MolecularWeight: 305.71308

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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