methyl 2-(2-chlorophenyl)-5-methyl-3-nitro-6-oxidanyl-benzoate

Systemtic Name: methyl 2-(2-chlorophenyl)-5-methyl-3-nitro-6-oxidanyl-benzoate Openeye Name: methyl 2-(2-chlorophenyl)-6-hydroxy-5-methyl-3-nitro-benzoate CAS Name: 2-(2-chlorophenyl)-6-hydroxy-5-methyl-3-nitrobenzoic acid methyl ester IUPAC Name: methyl 2-(2-chlorophenyl)-6-hydroxy-5-methyl-3-nitrobenzoate Traditional Name: 2-(2-chlorophenyl)-6-hydroxy-5-methyl-3-nitro-benzoic acid methyl ester Formula: C15H12ClNO5 MolecularWeight: 321.71248

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1O)C(=O)OC)C2=CC=CC=C2Cl)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C(=C1O)C(=O)OC)C2=CC=CC=C2Cl)[N+](=O)[O-]

InChI

InChI=1S/C15H12ClNO5/c1-8-7-11(17(20)21)12(9-5-3-4-6-10(9)16)13(14(8)18)15(19)22-2/h3-7,18H,1-2H3