ethyl 2-chloranyl-4-(3-nitro-4-phenyl-phenyl)butanoate

Systemtic Name: ethyl 2-chloranyl-4-(3-nitro-4-phenyl-phenyl)butanoate Openeye Name: ethyl 2-chloro-4-(3-nitro-4-phenyl-phenyl)butanoate CAS Name: 2-chloro-4-(3-nitro-4-phenylphenyl)butanoic acid ethyl ester IUPAC Name: ethyl 2-chloro-4-(3-nitro-4-phenylphenyl)butanoate Traditional Name: 2-chloro-4-(3-nitro-4-phenyl-phenyl)butyric acid ethyl ester Formula: C18H18ClNO4 MolecularWeight: 347.79282

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCC1=CC(=C(C=C1)C2=CC=CC=C2)[N+](=O)[O-])Cl

Isomeric SMILES

CCOC(=O)C(CCC1=CC(=C(C=C1)C2=CC=CC=C2)[N+](=O)[O-])Cl

InChI

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