ethyl 5-[(4-nitrophenyl)methylamino]-2-oxidanyl-benzoate

Systemtic Name: ethyl 5-[(4-nitrophenyl)methylamino]-2-oxidanyl-benzoate Openeye Name: ethyl 2-hydroxy-5-[(4-nitrophenyl)methylamino]benzoate CAS Name: 2-hydroxy-5-[(4-nitrophenyl)methylamino]benzoic acid ethyl ester IUPAC Name: ethyl 2-hydroxy-5-[(4-nitrophenyl)methylamino]benzoate Traditional Name: 2-hydroxy-5-[(4-nitrobenzyl)amino]benzoic acid ethyl ester Formula: C16H16N2O5 MolecularWeight: 316.30864

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=CC(=C1)NCC2=CC=C(C=C2)[N+](=O)[O-])O

Isomeric SMILES

CCOC(=O)C1=C(C=CC(=C1)NCC2=CC=C(C=C2)[N+](=O)[O-])O

InChI

InChI=1S/C16H16N2O5/c1-2-23-16(20)14-9-12(5-8-15(14)19)17-10-11-3-6-13(7-4-11)18(21)22/h3-9,17,19H,2,10H2,1H3