[2-acetyloxy-3-nitro-4-(4-phenylbutanoyl)phenyl] ethanoate

Systemtic Name: [2-acetyloxy-3-nitro-4-(4-phenylbutanoyl)phenyl] ethanoate Openeye Name: [2-acetoxy-3-nitro-4-(4-phenylbutanoyl)phenyl] acetate CAS Name: acetic acid [2-acetyloxy-3-nitro-4-(1-oxo-4-phenylbutyl)phenyl] ester IUPAC Name: [2-acetyloxy-3-nitro-4-(4-phenylbutanoyl)phenyl] acetate Traditional Name: acetic acid [2-acetoxy-3-nitro-4-(4-phenylbutanoyl)phenyl] ester Formula: C20H19NO7 MolecularWeight: 385.36736

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C(C(=C(C=C1)C(=O)CCCC2=CC=CC=C2)[N+](=O)[O-])OC(=O)C

Isomeric SMILES

CC(=O)OC1=C(C(=C(C=C1)C(=O)CCCC2=CC=CC=C2)[N+](=O)[O-])OC(=O)C

InChI

InChI=1S/C20H19NO7/c1-13(22)27-18-12-11-16(19(21(25)26)20(18)28-14(2)23)17(24)10-6-9-15-7-4-3-5-8-15/h3-5,7-8,11-12H,6,9-10H2,1-2H3