N-[4-(cyanomethyl)phenyl]-4-morpholin-4-yl-3-nitro-benzamide

Systemtic Name: N-[4-(cyanomethyl)phenyl]-4-morpholin-4-yl-3-nitro-benzamide Openeye Name: N-[4-(cyanomethyl)phenyl]-4-morpholino-3-nitro-benzamide CAS Name: N-[4-(cyanomethyl)phenyl]-4-(4-morpholinyl)-3-nitrobenzamide IUPAC Name: N-[4-(cyanomethyl)phenyl]-4-morpholin-4-yl-3-nitrobenzamide Traditional Name: N-[4-(cyanomethyl)phenyl]-4-morpholino-3-nitro-benzamide Formula: C19H18N4O4 MolecularWeight: 366.37062

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C=C(C=C2)C(=O)NC3=CC=C(C=C3)CC#N)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1C2=C(C=C(C=C2)C(=O)NC3=CC=C(C=C3)CC#N)[N+](=O)[O-]

InChI

InChI=1S/C19H18N4O4/c20-8-7-14-1-4-16(5-2-14)21-19(24)15-3-6-17(18(13-15)23(25)26)22-9-11-27-12-10-22/h1-6,13H,7,9-12H2,(H,21,24)