(2-chloranyl-5-methyl-phenyl) 2-morpholin-4-yl-5-nitro-benzoate

Systemtic Name: (2-chloranyl-5-methyl-phenyl) 2-morpholin-4-yl-5-nitro-benzoate Openeye Name: (2-chloro-5-methyl-phenyl) 2-morpholino-5-nitro-benzoate CAS Name: 2-(4-morpholinyl)-5-nitrobenzoic acid (2-chloro-5-methylphenyl) ester IUPAC Name: (2-chloro-5-methylphenyl) 2-morpholin-4-yl-5-nitrobenzoate Traditional Name: 2-morpholino-5-nitro-benzoic acid (2-chloro-5-methyl-phenyl) ester Formula: C18H17ClN2O5 MolecularWeight: 376.79098

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)Cl)OC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N3CCOCC3

Isomeric SMILES

CC1=CC(=C(C=C1)Cl)OC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N3CCOCC3

InChI

InChI=1S/C18H17ClN2O5/c1-12-2-4-15(19)17(10-12)26-18(22)14-11-13(21(23)24)3-5-16(14)20-6-8-25-9-7-20/h2-5,10-11H,6-9H2,1H3