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

Systemtic Name: N-[5-[5-(hydroxymethyl)furan-2-yl]-2-methyl-phenyl]-4-methoxy-3-nitro-benzamide Openeye Name: N-[5-[5-(hydroxymethyl)-2-furyl]-2-methyl-phenyl]-4-methoxy-3-nitro-benzamide CAS Name: N-[5-[5-(hydroxymethyl)-2-furanyl]-2-methylphenyl]-4-methoxy-3-nitrobenzamide IUPAC Name: N-[5-[5-(hydroxymethyl)furan-2-yl]-2-methylphenyl]-4-methoxy-3-nitrobenzamide Traditional Name: 4-methoxy-N-[2-methyl-5-(5-methylol-2-furyl)phenyl]-3-nitro-benzamide Formula: C20H18N2O6 MolecularWeight: 382.36672

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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)OC)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C20H18N2O6/c1-12-3-4-13(18-8-6-15(11-23)28-18)9-16(12)21-20(24)14-5-7-19(27-2)17(10-14)22(25)26/h3-10,23H,11H2,1-2H3,(H,21,24)