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

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

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N3CCOCC3)C4=CC=C(O4)CO

Isomeric SMILES

COC1=C(C=CC(=C1)NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N3CCOCC3)C4=CC=C(O4)CO

InChI

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