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

Systemtic Name: (4-methylphenyl)methyl 2-azanyl-5-nitro-benzoate Openeye Name: p-tolylmethyl 2-amino-5-nitro-benzoate CAS Name: 2-amino-5-nitrobenzoic acid (4-methylphenyl)methyl ester IUPAC Name: (4-methylphenyl)methyl 2-amino-5-nitrobenzoate Traditional Name: 2-amino-5-nitro-benzoic acid (4-methylbenzyl) ester Formula: C15H14N2O4 MolecularWeight: 286.28266

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H14N2O4/c1-10-2-4-11(5-3-10)9-21-15(18)13-8-12(17(19)20)6-7-14(13)16/h2-8H,9,16H2,1H3