(2-chlorophenyl)methyl 4-azanyl-3-nitro-benzoate

Systemtic Name: (2-chlorophenyl)methyl 4-azanyl-3-nitro-benzoate Openeye Name: (2-chlorophenyl)methyl 4-amino-3-nitro-benzoate CAS Name: 4-amino-3-nitrobenzoic acid (2-chlorophenyl)methyl ester IUPAC Name: (2-chlorophenyl)methyl 4-amino-3-nitrobenzoate Traditional Name: 4-amino-3-nitro-benzoic acid (2-chlorobenzyl) ester Formula: C14H11ClN2O4 MolecularWeight: 306.70114

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H11ClN2O4/c15-11-4-2-1-3-10(11)8-21-14(18)9-5-6-12(16)13(7-9)17(19)20/h1-7H,8,16H2