N-[5-[5-(hydroxymethyl)furan-2-yl]-2-methoxy-phenyl]-4-morpholin-4-yl-3-nitro-benzamide

Systemtic Name: N-[5-[5-(hydroxymethyl)furan-2-yl]-2-methoxy-phenyl]-4-morpholin-4-yl-3-nitro-benzamide Openeye Name: N-[5-[5-(hydroxymethyl)-2-furyl]-2-methoxy-phenyl]-4-morpholino-3-nitro-benzamide CAS Name: N-[5-[5-(hydroxymethyl)-2-furanyl]-2-methoxyphenyl]-4-(4-morpholinyl)-3-nitrobenzamide IUPAC Name: N-[5-[5-(hydroxymethyl)furan-2-yl]-2-methoxyphenyl]-4-morpholin-4-yl-3-nitrobenzamide Traditional Name: N-[2-methoxy-5-(5-methylol-2-furyl)phenyl]-4-morpholino-3-nitro-benzamide Formula: C23H23N3O7 MolecularWeight: 453.44462

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=CC=C(O2)CO)NC(=O)C3=CC(=C(C=C3)N4CCOCC4)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)C2=CC=C(O2)CO)NC(=O)C3=CC(=C(C=C3)N4CCOCC4)[N+](=O)[O-]

InChI

InChI=1S/C23H23N3O7/c1-31-22-6-3-15(21-7-4-17(14-27)33-21)12-18(22)24-23(28)16-2-5-19(20(13-16)26(29)30)25-8-10-32-11-9-25/h2-7,12-13,27H,8-11,14H2,1H3,(H,24,28)