N-[4-(1,3-benzoxazol-2-yl)phenyl]-4-morpholin-4-yl-3-nitro-benzamide

Systemtic Name: N-[4-(1,3-benzoxazol-2-yl)phenyl]-4-morpholin-4-yl-3-nitro-benzamide Openeye Name: N-[4-(1,3-benzoxazol-2-yl)phenyl]-4-morpholino-3-nitro-benzamide CAS Name: N-[4-(1,3-benzoxazol-2-yl)phenyl]-4-(4-morpholinyl)-3-nitrobenzamide IUPAC Name: N-[4-(1,3-benzoxazol-2-yl)phenyl]-4-morpholin-4-yl-3-nitrobenzamide Traditional Name: N-[4-(1,3-benzoxazol-2-yl)phenyl]-4-morpholino-3-nitro-benzamide Formula: C24H20N4O5 MolecularWeight: 444.4394

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C=C(C=C2)C(=O)NC3=CC=C(C=C3)C4=NC5=CC=CC=C5O4)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1C2=C(C=C(C=C2)C(=O)NC3=CC=C(C=C3)C4=NC5=CC=CC=C5O4)[N+](=O)[O-]

InChI

InChI=1S/C24H20N4O5/c29-23(17-7-10-20(21(15-17)28(30)31)27-11-13-32-14-12-27)25-18-8-5-16(6-9-18)24-26-19-3-1-2-4-22(19)33-24/h1-10,15H,11-14H2,(H,25,29)