ethyl 3-(4-chlorophenyl)-2-ethanoyl-4-methyl-4-nitro-pentanoate

Systemtic Name: ethyl 3-(4-chlorophenyl)-2-ethanoyl-4-methyl-4-nitro-pentanoate Openeye Name: ethyl 2-acetyl-3-(4-chlorophenyl)-4-methyl-4-nitro-pentanoate CAS Name: 2-acetyl-3-(4-chlorophenyl)-4-methyl-4-nitropentanoic acid ethyl ester IUPAC Name: ethyl 2-acetyl-3-(4-chlorophenyl)-4-methyl-4-nitropentanoate Traditional Name: 2-acetyl-3-(4-chlorophenyl)-4-methyl-4-nitro-valeric acid ethyl ester Formula: C16H20ClNO5 MolecularWeight: 341.7867

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(C1=CC=C(C=C1)Cl)C(C)(C)[N+](=O)[O-])C(=O)C

Isomeric SMILES

CCOC(=O)C(C(C1=CC=C(C=C1)Cl)C(C)(C)[N+](=O)[O-])C(=O)C

InChI

InChI=1S/C16H20ClNO5/c1-5-23-15(20)13(10(2)19)14(16(3,4)18(21)22)11-6-8-12(17)9-7-11/h6-9,13-14H,5H2,1-4H3