pyridin-2-ylmethyl 4-(methylamino)-3-nitro-benzoate

Systemtic Name: pyridin-2-ylmethyl 4-(methylamino)-3-nitro-benzoate Openeye Name: 2-pyridylmethyl 4-(methylamino)-3-nitro-benzoate CAS Name: 4-(methylamino)-3-nitrobenzoic acid 2-pyridinylmethyl ester IUPAC Name: pyridin-2-ylmethyl 4-(methylamino)-3-nitrobenzoate Traditional Name: 4-(methylamino)-3-nitro-benzoic acid 2-pyridylmethyl ester Formula: C14H13N3O4 MolecularWeight: 287.27072

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=C(C=C(C=C1)C(=O)OCC2=CC=CC=N2)[N+](=O)[O-]

Isomeric SMILES

CNC1=C(C=C(C=C1)C(=O)OCC2=CC=CC=N2)[N+](=O)[O-]

InChI

InChI=1S/C14H13N3O4/c1-15-12-6-5-10(8-13(12)17(19)20)14(18)21-9-11-4-2-3-7-16-11/h2-8,15H,9H2,1H3