imidazo[1,2-a]pyridin-2-ylmethyl 2-(2-hydroxyethylamino)-5-nitro-benzoate

Systemtic Name: imidazo[1,2-a]pyridin-2-ylmethyl 2-(2-hydroxyethylamino)-5-nitro-benzoate Openeye Name: imidazo[1,2-a]pyridin-2-ylmethyl 2-(2-hydroxyethylamino)-5-nitro-benzoate CAS Name: 2-(2-hydroxyethylamino)-5-nitrobenzoic acid 2-imidazo[1,2-a]pyridinylmethyl ester IUPAC Name: imidazo[1,2-a]pyridin-2-ylmethyl 2-(2-hydroxyethylamino)-5-nitrobenzoate Traditional Name: 2-(2-hydroxyethylamino)-5-nitro-benzoic acid imidazo[1,2-a]pyridin-2-ylmethyl ester Formula: C17H16N4O5 MolecularWeight: 356.33274

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=NC(=CN2C=C1)COC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])NCCO

Isomeric SMILES

C1=CC2=NC(=CN2C=C1)COC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])NCCO

InChI

InChI=1S/C17H16N4O5/c22-8-6-18-15-5-4-13(21(24)25)9-14(15)17(23)26-11-12-10-20-7-2-1-3-16(20)19-12/h1-5,7,9-10,18,22H,6,8,11H2