ethyl (2R)-2-(1,3-benzoxazol-2-yl)-2-(3-nitropyridin-2-yl)ethanoate

Systemtic Name: ethyl (2R)-2-(1,3-benzoxazol-2-yl)-2-(3-nitropyridin-2-yl)ethanoate Openeye Name: ethyl (2R)-2-(1,3-benzoxazol-2-yl)-2-(3-nitro-2-pyridyl)acetate CAS Name: (2R)-2-(1,3-benzoxazol-2-yl)-2-(3-nitro-2-pyridinyl)acetic acid ethyl ester IUPAC Name: ethyl (2R)-2-(1,3-benzoxazol-2-yl)-2-(3-nitropyridin-2-yl)acetate Traditional Name: (2R)-2-(1,3-benzoxazol-2-yl)-2-(3-nitro-2-pyridyl)acetic acid ethyl ester Formula: C16H13N3O5 MolecularWeight: 327.29152

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C1=C(C=CC=N1)[N+](=O)[O-])C2=NC3=CC=CC=C3O2

Isomeric SMILES

CCOC(=O)[C@H](C1=C(C=CC=N1)[N+](=O)[O-])C2=NC3=CC=CC=C3O2

InChI

InChI=1S/C16H13N3O5/c1-2-23-16(20)13(14-11(19(21)22)7-5-9-17-14)15-18-10-6-3-4-8-12(10)24-15/h3-9,13H,2H2,1H3/t13-/m1/s1