N-[1-(4-ethylphenyl)ethyl]-2-morpholin-4-yl-5-nitro-benzamide

Systemtic Name: N-[1-(4-ethylphenyl)ethyl]-2-morpholin-4-yl-5-nitro-benzamide Openeye Name: N-[1-(4-ethylphenyl)ethyl]-2-morpholino-5-nitro-benzamide CAS Name: N-[1-(4-ethylphenyl)ethyl]-2-(4-morpholinyl)-5-nitrobenzamide IUPAC Name: N-[1-(4-ethylphenyl)ethyl]-2-morpholin-4-yl-5-nitrobenzamide Traditional Name: N-[1-(4-ethylphenyl)ethyl]-2-morpholino-5-nitro-benzamide Formula: C21H25N3O4 MolecularWeight: 383.4409

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(C)NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N3CCOCC3

Isomeric SMILES

CCC1=CC=C(C=C1)C(C)NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N3CCOCC3

InChI

InChI=1S/C21H25N3O4/c1-3-16-4-6-17(7-5-16)15(2)22-21(25)19-14-18(24(26)27)8-9-20(19)23-10-12-28-13-11-23/h4-9,14-15H,3,10-13H2,1-2H3,(H,22,25)