methyl 5-[[(2-chloranyl-4-nitro-phenyl)amino]methyl]-2-methoxy-benzoate

Systemtic Name: methyl 5-[[(2-chloranyl-4-nitro-phenyl)amino]methyl]-2-methoxy-benzoate Openeye Name: methyl 5-[(2-chloro-4-nitro-anilino)methyl]-2-methoxy-benzoate CAS Name: 5-[(2-chloro-4-nitroanilino)methyl]-2-methoxybenzoic acid methyl ester IUPAC Name: methyl 5-[(2-chloro-4-nitroanilino)methyl]-2-methoxybenzoate Traditional Name: 5-[(2-chloro-4-nitro-anilino)methyl]-2-methoxy-benzoic acid methyl ester Formula: C16H15ClN2O5 MolecularWeight: 350.7537

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC2=C(C=C(C=C2)[N+](=O)[O-])Cl)C(=O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CNC2=C(C=C(C=C2)[N+](=O)[O-])Cl)C(=O)OC

InChI

InChI=1S/C16H15ClN2O5/c1-23-15-6-3-10(7-12(15)16(20)24-2)9-18-14-5-4-11(19(21)22)8-13(14)17/h3-8,18H,9H2,1-2H3