2-(pyridin-3-ylcarbonylamino)ethyl 3-nitrobenzoate hydrochloride

Systemtic Name: 2-(pyridin-3-ylcarbonylamino)ethyl 3-nitrobenzoate hydrochloride Openeye Name: 2-(pyridine-3-carbonylamino)ethyl 3-nitrobenzoate hydrochloride CAS Name: 3-nitrobenzoic acid 2-[[oxo(3-pyridinyl)methyl]amino]ethyl ester hydrochloride IUPAC Name: 2-(pyridine-3-carbonylamino)ethyl 3-nitrobenzoate hydrochloride Traditional Name: 3-nitrobenzoic acid 2-nicotinamidoethyl ester hydrochloride Formula: C15H14ClN3O5 MolecularWeight: 351.74176

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)OCCNC(=O)C2=CN=CC=C2.Cl

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)OCCNC(=O)C2=CN=CC=C2.Cl

InChI

InChI=1S/C15H13N3O5.ClH/c19-14(12-4-2-6-16-10-12)17-7-8-23-15(20)11-3-1-5-13(9-11)18(21)22;/h1-6,9-10H,7-8H2,(H,17,19);1H