2-(2-phenyl-1,3-dioxolan-2-yl)ethyl 4-nitrobenzoate

Systemtic Name: 2-(2-phenyl-1,3-dioxolan-2-yl)ethyl 4-nitrobenzoate Openeye Name: 2-(2-phenyl-1,3-dioxolan-2-yl)ethyl 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid 2-(2-phenyl-1,3-dioxolan-2-yl)ethyl ester IUPAC Name: 2-(2-phenyl-1,3-dioxolan-2-yl)ethyl 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid 2-(2-phenyl-1,3-dioxolan-2-yl)ethyl ester Formula: C18H17NO6 MolecularWeight: 343.33068

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Descriptors Computed from Structure

Canonical SMILES:

C1COC(O1)(CCOC(=O)C2=CC=C(C=C2)[N+](=O)[O-])C3=CC=CC=C3

Isomeric SMILES

C1COC(O1)(CCOC(=O)C2=CC=C(C=C2)[N+](=O)[O-])C3=CC=CC=C3

InChI

InChI=1S/C18H17NO6/c20-17(14-6-8-16(9-7-14)19(21)22)23-11-10-18(24-12-13-25-18)15-4-2-1-3-5-15/h1-9H,10-13H2