butyl 2-(2-chloranyl-5-nitro-phenyl)-4-methyl-1,3-dioxolane-4-carboxylate

Systemtic Name: butyl 2-(2-chloranyl-5-nitro-phenyl)-4-methyl-1,3-dioxolane-4-carboxylate Openeye Name: butyl 2-(2-chloro-5-nitro-phenyl)-4-methyl-1,3-dioxolane-4-carboxylate CAS Name: 2-(2-chloro-5-nitrophenyl)-4-methyl-1,3-dioxolane-4-carboxylic acid butyl ester IUPAC Name: butyl 2-(2-chloro-5-nitrophenyl)-4-methyl-1,3-dioxolane-4-carboxylate Traditional Name: 2-(2-chloro-5-nitro-phenyl)-4-methyl-1,3-dioxolane-4-carboxylic acid butyl ester Formula: C15H18ClNO6 MolecularWeight: 343.75952

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1(COC(O1)C2=C(C=CC(=C2)[N+](=O)[O-])Cl)C

Isomeric SMILES

CCCCOC(=O)C1(COC(O1)C2=C(C=CC(=C2)[N+](=O)[O-])Cl)C

InChI

InChI=1S/C15H18ClNO6/c1-3-4-7-21-14(18)15(2)9-22-13(23-15)11-8-10(17(19)20)5-6-12(11)16/h5-6,8,13H,3-4,7,9H2,1-2H3