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

Systemtic Name: N-[5-[5-(hydroxymethyl)furan-2-yl]-2-methyl-phenyl]-4-morpholin-4-yl-3-nitro-benzamide Openeye Name: N-[5-[5-(hydroxymethyl)-2-furyl]-2-methyl-phenyl]-4-morpholino-3-nitro-benzamide CAS Name: N-[5-[5-(hydroxymethyl)-2-furanyl]-2-methylphenyl]-4-(4-morpholinyl)-3-nitrobenzamide IUPAC Name: N-[5-[5-(hydroxymethyl)furan-2-yl]-2-methylphenyl]-4-morpholin-4-yl-3-nitrobenzamide Traditional Name: N-[2-methyl-5-(5-methylol-2-furyl)phenyl]-4-morpholino-3-nitro-benzamide Formula: C23H23N3O6 MolecularWeight: 437.44522

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=CC=C(O2)CO)NC(=O)C3=CC(=C(C=C3)N4CCOCC4)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C2=CC=C(O2)CO)NC(=O)C3=CC(=C(C=C3)N4CCOCC4)[N+](=O)[O-]

InChI

InChI=1S/C23H23N3O6/c1-15-2-3-16(22-7-5-18(14-27)32-22)12-19(15)24-23(28)17-4-6-20(21(13-17)26(29)30)25-8-10-31-11-9-25/h2-7,12-13,27H,8-11,14H2,1H3,(H,24,28)