ethyl 4-chloranyl-4-(3-nitro-4-phenyl-phenyl)butanoate

Systemtic Name: ethyl 4-chloranyl-4-(3-nitro-4-phenyl-phenyl)butanoate Openeye Name: ethyl 4-chloro-4-(3-nitro-4-phenyl-phenyl)butanoate CAS Name: 4-chloro-4-(3-nitro-4-phenylphenyl)butanoic acid ethyl ester IUPAC Name: ethyl 4-chloro-4-(3-nitro-4-phenylphenyl)butanoate Traditional Name: 4-chloro-4-(3-nitro-4-phenyl-phenyl)butyric acid ethyl ester Formula: C18H18ClNO4 MolecularWeight: 347.79282

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC(C1=CC(=C(C=C1)C2=CC=CC=C2)[N+](=O)[O-])Cl

Isomeric SMILES

CCOC(=O)CCC(C1=CC(=C(C=C1)C2=CC=CC=C2)[N+](=O)[O-])Cl

InChI

InChI=1S/C18H18ClNO4/c1-2-24-18(21)11-10-16(19)14-8-9-15(17(12-14)20(22)23)13-6-4-3-5-7-13/h3-9,12,16H,2,10-11H2,1H3