(2-cyanophenyl)methyl 2-(6-nitro-2-oxidanylidene-1,3-benzoxazol-3-yl)ethanoate

Systemtic Name: (2-cyanophenyl)methyl 2-(6-nitro-2-oxidanylidene-1,3-benzoxazol-3-yl)ethanoate Openeye Name: (2-cyanophenyl)methyl 2-(6-nitro-2-oxo-1,3-benzoxazol-3-yl)acetate CAS Name: 2-(6-nitro-2-oxo-1,3-benzoxazol-3-yl)acetic acid (2-cyanophenyl)methyl ester IUPAC Name: (2-cyanophenyl)methyl 2-(6-nitro-2-oxo-1,3-benzoxazol-3-yl)acetate Traditional Name: 2-(2-keto-6-nitro-1,3-benzoxazol-3-yl)acetic acid (2-cyanobenzyl) ester Formula: C17H11N3O6 MolecularWeight: 353.28574

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)COC(=O)CN2C3=C(C=C(C=C3)[N+](=O)[O-])OC2=O)C#N

Isomeric SMILES

C1=CC=C(C(=C1)COC(=O)CN2C3=C(C=C(C=C3)[N+](=O)[O-])OC2=O)C#N

InChI

InChI=1S/C17H11N3O6/c18-8-11-3-1-2-4-12(11)10-25-16(21)9-19-14-6-5-13(20(23)24)7-15(14)26-17(19)22/h1-7H,9-10H2