(2-methoxy-5-methyl-phenyl)methyl 2-chloranyl-5-nitro-benzoate

Systemtic Name: (2-methoxy-5-methyl-phenyl)methyl 2-chloranyl-5-nitro-benzoate Openeye Name: (2-methoxy-5-methyl-phenyl)methyl 2-chloro-5-nitro-benzoate CAS Name: 2-chloro-5-nitrobenzoic acid (2-methoxy-5-methylphenyl)methyl ester IUPAC Name: (2-methoxy-5-methylphenyl)methyl 2-chloro-5-nitrobenzoate Traditional Name: 2-chloro-5-nitro-benzoic acid (2-methoxy-5-methyl-benzyl) ester Formula: C16H14ClNO5 MolecularWeight: 335.73906

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H14ClNO5/c1-10-3-6-15(22-2)11(7-10)9-23-16(19)13-8-12(18(20)21)4-5-14(13)17/h3-8H,9H2,1-2H3